N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

C11H13N3O2 — CID 110474928

IUPACN-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
SMILESCC(O)CNC(=O)c1c[nH]c2ncccc12
InChIInChI=1S/C11H13N3O2/c1-7(15)5-14-11(16)9-6-13-10-8(9)3-2-4-12-10/h2-4,6-7,15H,5H2,1H3,(H,12,13)(H,14,16)
InChIKeyYLMIOWWQDFZSLX-UHFFFAOYSA-N
MW219.24 g/mol
LogP0.67
Rot. Bonds3

About N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide (PubChem CID 110474928) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
PubChem CID110474928
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC NameN-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
SMILESCC(O)CNC(=O)c1c[nH]c2ncccc12
InChIInChI=1S/C11H13N3O2/c1-7(15)5-14-11(16)9-6-13-10-8(9)3-2-4-12-10/h2-4,6-7,15H,5H2,1H3,(H,12,13)(H,14,16)
InChIKeyYLMIOWWQDFZSLX-UHFFFAOYSA-N
XLogP0.67
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(methylamino)propyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 120829117
N-propyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 110474919
N-prop-2-enyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 110474918
N-[(2R)-2-hydroxypropyl]-2-methylsulfanylpyridine-3-carboxamide
CID 83032320
2-bromo-N-[(2R)-2-hydroxypropyl]pyridine-3-carboxamide
CID 103886003
2-chloro-N-[(2R)-2-hydroxypropyl]pyridine-3-carboxamide
CID 93419851
(2S)-4-methyl-2-(1H-pyrrolo[2,3-b]pyridine-3-carbonylamino)pentanoic acid
CID 119360770
bis(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 151992527
N-(2-hydroxypropyl)benzo[f]quinoline-5-carboxamide
CID 110893927
2-chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone
CID 12778217
N-(2-hydroxy-3-methylbutyl)-1H-indole-3-carboxamide
CID 113268799
2,2-dimethyl-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)propan-1-one
CID 43161303

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide (CID 110474928) is N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide is CC(O)CNC(=O)c1c[nH]c2ncccc12.
What is the InChIKey of N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide?
The InChIKey is YLMIOWWQDFZSLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c1-7(15)5-14-11(16)9-6-13-10-8(9)3-2-4-12-10/h2-4,6-7,15H,5H2,1H3,(H,12,13)(H,14,16).
What are the key properties of N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide?
N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide has a molecular weight of 219.24 g/mol, XLogP of 0.67, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide is sourced from PubChem (CID 110474928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).