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Details

Stereochemistry ACHIRAL
Molecular Formula C5H12N2O
Molecular Weight 116.1616
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-BUTYLUREA

SMILES

CCCCNC(N)=O

InChI

InChIKey=CNWSQCLBDWYLAN-UHFFFAOYSA-N
InChI=1S/C5H12N2O/c1-2-3-4-7-5(6)8/h2-4H2,1H3,(H3,6,7,8)

HIDE SMILES / InChI

Molecular Formula C5H12N2O
Molecular Weight 116.1616
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Novel synthesis of ureas: application of t-butylureas.
2010-01
Potent and selective small molecule NS3 serine protease inhibitors of Hepatitis C virus with dichlorocyclopropylproline as P2 residue.
2008-02-15
Synthesis and biological evaluation of homoserine lactone derived ureas as antagonists of bacterial quorum sensing.
2006-07-15
Specific modification of peptide-bound citrulline residues.
2006-05-01
A quadruply hydrogen bonded heterocomplex displaying high-fidelity recognition.
2005-12-28
A highly stable quadruply hydrogen-bonded heterocomplex useful for supramolecular polymer blends.
2005-05-11
Preclinical studies of alkylureas as anti-HIV-1 contraceptive.
2005
Chalcogens as terminal ligands to iron: synthesis and structure of complexes with Fe(III)-S and Fe(III)-Se motifs.
2004-06-02
Discovery of novel benzothiazolesulfonamides as potent inhibitors of HIV-1 protease.
2003-11-03
Inhibition of HIV-1 infection by alkylureas.
1991-12
Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:14:05 GMT 2025
Edited
by admin
on Mon Mar 31 19:14:05 GMT 2025
Record UNII
9CPL5NR15K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-2597
Preferred Name English
N-BUTYLUREA
HSDB  
Systematic Name English
BUTYLUREA
Systematic Name English
UREA, BUTYL-
Systematic Name English
N-BUTYLUREA [HSDB]
Common Name English
1-BUTYLUREA
Systematic Name English
UREA, N-BUTYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
11595
Created by admin on Mon Mar 31 19:14:05 GMT 2025 , Edited by admin on Mon Mar 31 19:14:05 GMT 2025
PRIMARY
HSDB
5497
Created by admin on Mon Mar 31 19:14:05 GMT 2025 , Edited by admin on Mon Mar 31 19:14:05 GMT 2025
PRIMARY
FDA UNII
9CPL5NR15K
Created by admin on Mon Mar 31 19:14:05 GMT 2025 , Edited by admin on Mon Mar 31 19:14:05 GMT 2025
PRIMARY
NSC
2597
Created by admin on Mon Mar 31 19:14:05 GMT 2025 , Edited by admin on Mon Mar 31 19:14:05 GMT 2025
PRIMARY
ECHA (EC/EINECS)
209-748-4
Created by admin on Mon Mar 31 19:14:05 GMT 2025 , Edited by admin on Mon Mar 31 19:14:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID6020222
Created by admin on Mon Mar 31 19:14:05 GMT 2025 , Edited by admin on Mon Mar 31 19:14:05 GMT 2025
PRIMARY
CAS
592-31-4
Created by admin on Mon Mar 31 19:14:05 GMT 2025 , Edited by admin on Mon Mar 31 19:14:05 GMT 2025
PRIMARY