N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide

C15H20N4O — CID 166270354

IUPACN-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide
SMILESCC1(CNC(=O)c2ccnc3[nH]ccc23)CCNCC1
InChIInChI=1S/C15H20N4O/c1-15(4-8-16-9-5-15)10-19-14(20)12-3-7-18-13-11(12)2-6-17-13/h2-3,6-7,16H,4-5,8-10H2,1H3,(H,17,18)(H,19,20)
InChIKeyOIIHMKVWWCVIAE-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.68
Rot. Bonds3

About N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide

N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide (PubChem CID 166270354) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide
PubChem CID166270354
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide
SMILESCC1(CNC(=O)c2ccnc3[nH]ccc23)CCNCC1
InChIInChI=1S/C15H20N4O/c1-15(4-8-16-9-5-15)10-19-14(20)12-3-7-18-13-11(12)2-6-17-13/h2-3,6-7,16H,4-5,8-10H2,1H3,(H,17,18)(H,19,20)
InChIKeyOIIHMKVWWCVIAE-UHFFFAOYSA-N
XLogP1.68
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1H-pyrrolo[2,3-b]pyridine-4-carboxamide
CID 23515094
N-(1-hydroxy-2-methylpropan-2-yl)-1H-pyrrolo[2,3-b]pyridine-4-carboxamide
CID 20784555
1-methyl-N-[(4-methylpiperidin-4-yl)methyl]pyrazole-3-carboxamide
CID 103121074
N-propyl-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzamide
CID 58897016
4-methyl-4-[[(7-oxo-1,6-dihydropyrrolo[2,3-c]pyridine-4-carbonyl)amino]methyl]piperidine-1-carboxylic acid
CID 175009560
2-chloro-N-[(1-methylcyclopropyl)methyl]-3-nitropyridine-4-carboxamide
CID 113248375
(3,3-dimethyl-2-pyridin-3-ylazetidin-1-yl)-(1H-pyrrolo[2,3-b]pyridin-4-yl)methanone
CID 166268676
1-ethyl-N-[(4-methylpiperidin-4-yl)methyl]pyrazole-4-carboxamide
CID 99821300
N-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine-4-carboxamide
CID 166321044
N-[(1-methylcyclopentyl)methyl]-1,2,3,4-tetrahydroisoquinoline-5-carboxamide
CID 104558596
5-fluoro-2-hydroxy-N-[(3-methylpyrrolidin-3-yl)methyl]benzamide
CID 114217968
3-hydroxy-2-methyl-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103873632

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide?
The IUPAC name of N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide (CID 166270354) is N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide.
What is the SMILES notation for N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide?
The canonical SMILES for N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide is CC1(CNC(=O)c2ccnc3[nH]ccc23)CCNCC1.
What is the InChIKey of N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide?
The InChIKey is OIIHMKVWWCVIAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-15(4-8-16-9-5-15)10-19-14(20)12-3-7-18-13-11(12)2-6-17-13/h2-3,6-7,16H,4-5,8-10H2,1H3,(H,17,18)(H,19,20).
What are the key properties of N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide?
N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.68, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylpiperidin-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-4-carboxamide is sourced from PubChem (CID 166270354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).