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Details

Stereochemistry ABSOLUTE
Molecular Formula C7H14N2
Molecular Weight 126.1995
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MDL-72175

SMILES

C[C@@H](N)CC[C@@H](N)C#C

InChI

InChIKey=QIADQCOYEFCREQ-RQJHMYQMSA-N
InChI=1S/C7H14N2/c1-3-7(9)5-4-6(2)8/h1,6-7H,4-5,8-9H2,2H3/t6-,7+/m1/s1

HIDE SMILES / InChI

Molecular Formula C7H14N2
Molecular Weight 126.1995
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:07:11 GMT 2025
Edited
by admin
on Mon Mar 31 22:07:11 GMT 2025
Record UNII
2KJV7DY3J4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2R,5R)-6-heptyne-2,5-diamine
Preferred Name English
MDL-72175
Code English
6-Heptyne-2,5-diamine, (2R,5R)-
Systematic Name English
MDL 72175
Code English
Code System Code Type Description
PUBCHEM
122175
Created by admin on Mon Mar 31 22:07:11 GMT 2025 , Edited by admin on Mon Mar 31 22:07:11 GMT 2025
PRIMARY
EPA CompTox
DTXSID801002114
Created by admin on Mon Mar 31 22:07:11 GMT 2025 , Edited by admin on Mon Mar 31 22:07:11 GMT 2025
PRIMARY
CAS
88192-22-7
Created by admin on Mon Mar 31 22:07:11 GMT 2025 , Edited by admin on Mon Mar 31 22:07:11 GMT 2025
PRIMARY
FDA UNII
2KJV7DY3J4
Created by admin on Mon Mar 31 22:07:11 GMT 2025 , Edited by admin on Mon Mar 31 22:07:11 GMT 2025
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
IRREVERSIBLE INHIBITOR