3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide

C17H19N5O — CID 175642857

IUPAC3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
SMILESCC(C)Cn1cnc2cc(C(=O)NCc3cccnc3)cnc21
InChIInChI=1S/C17H19N5O/c1-12(2)10-22-11-21-15-6-14(9-19-16(15)22)17(23)20-8-13-4-3-5-18-7-13/h3-7,9,11-12H,8,10H2,1-2H3,(H,20,23)
InChIKeyAJZVSXNQBJBIFF-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.41
Rot. Bonds5

About 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide

3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 175642857) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
PubChem CID175642857
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC Name3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
SMILESCC(C)Cn1cnc2cc(C(=O)NCc3cccnc3)cnc21
InChIInChI=1S/C17H19N5O/c1-12(2)10-22-11-21-15-6-14(9-19-16(15)22)17(23)20-8-13-4-3-5-18-7-13/h3-7,9,11-12H,8,10H2,1-2H3,(H,20,23)
InChIKeyAJZVSXNQBJBIFF-UHFFFAOYSA-N
XLogP2.41
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-N-(3-methylbutyl)-5-N-(pyridin-3-ylmethyl)pyridine-3,5-dicarboxamide
CID 109106009
N-[2-(1-methylpyrrolidin-2-yl)ethyl]-3-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 175645040
5-(2-methylpropylamino)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 109224955
4-propan-2-ylsulfanyl-N-(pyridin-3-ylmethyl)benzamide
CID 47265352
N-[3-(furan-2-yl)propyl]-3-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176504746
N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;hydrochloride
CID 110755498
3-propan-2-yloxy-N-(pyridin-3-ylmethyl)benzamide
CID 4552071
4-(3-methylbutoxy)-N-(pyridin-3-ylmethyl)benzamide
CID 17199623
1-[ethenyl(methyl)amino]-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide
CID 143011546
1-methyl-3-N,5-N-bis(pyridin-3-ylmethyl)pyrazole-3,5-dicarboxamide
CID 29097126
6-bromo-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 66463466
N-[(1-propan-2-ylbenzimidazol-5-yl)methyl]pyridine-3-carboxamide
CID 50844462

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide (CID 175642857) is 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide is CC(C)Cn1cnc2cc(C(=O)NCc3cccnc3)cnc21.
What is the InChIKey of 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is AJZVSXNQBJBIFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O/c1-12(2)10-22-11-21-15-6-14(9-19-16(15)22)17(23)20-8-13-4-3-5-18-7-13/h3-7,9,11-12H,8,10H2,1-2H3,(H,20,23).
What are the key properties of 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide?
3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropyl)-N-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 175642857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).