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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H19N5O
Molecular Weight 273.3336
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (3R,4R)-4-Methyl-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinecarboxaldehyde

SMILES

C[C@@H]1CCN(C[C@@H]1N(C)C2=C3C=CNC3=NC=N2)C=O

InChI

InChIKey=IWOOTPDLQXSWDV-PWSUYJOCSA-N
InChI=1S/C14H19N5O/c1-10-4-6-19(9-20)7-12(10)18(2)14-11-3-5-15-13(11)16-8-17-14/h3,5,8-10,12H,4,6-7H2,1-2H3,(H,15,16,17)/t10-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H19N5O
Molecular Weight 273.3336
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 Wed Apr 02 17:05:39 GMT 2025
Edited
by admin
on Wed Apr 02 17:05:39 GMT 2025
Record UNII
X8AA7KVD2Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(3R,4R)-4-Methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidine-1-carbaldehyde
Preferred Name English
(3R,4R)-4-Methyl-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1-piperidinecarboxaldehyde
Systematic Name English
1-Piperidinecarboxaldehyde, 4-methyl-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-, (3R,4R)-
Systematic Name English
Code System Code Type Description
CAS
2227199-28-0
Created by admin on Wed Apr 02 17:05:39 GMT 2025 , Edited by admin on Wed Apr 02 17:05:39 GMT 2025
PRIMARY
PUBCHEM
135392613
Created by admin on Wed Apr 02 17:05:39 GMT 2025 , Edited by admin on Wed Apr 02 17:05:39 GMT 2025
PRIMARY
FDA UNII
X8AA7KVD2Q
Created by admin on Wed Apr 02 17:05:39 GMT 2025 , Edited by admin on Wed Apr 02 17:05:39 GMT 2025
PRIMARY