N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide

C14H20N4O2 — CID 110013000

IUPACN-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
SMILESCC(C)CC(O)CNC(=O)c1cnc2c(c1)ncn2C
InChIInChI=1S/C14H20N4O2/c1-9(2)4-11(19)7-16-14(20)10-5-12-13(15-6-10)18(3)8-17-12/h5-6,8-9,11,19H,4,7H2,1-3H3,(H,16,20)
InChIKeyRICZBUJCXMDYGK-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.11
Rot. Bonds5

About N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide

N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 110013000) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
PubChem CID110013000
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
SMILESCC(C)CC(O)CNC(=O)c1cnc2c(c1)ncn2C
InChIInChI=1S/C14H20N4O2/c1-9(2)4-11(19)7-16-14(20)10-5-12-13(15-6-10)18(3)8-17-12/h5-6,8-9,11,19H,4,7H2,1-3H3,(H,16,20)
InChIKeyRICZBUJCXMDYGK-UHFFFAOYSA-N
XLogP1.11
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-2-hydroxy-4-methylpentyl]-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 97014371
N-(cyanomethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 138042785
N-[(2S)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 97342015
N-(2-hydroxy-4-methylpentyl)-3-methylimidazole-4-carboxamide
CID 107155312
N-(2-hydroxy-4-methylpentyl)pyrimidine-5-carboxamide
CID 104629610
6-(benzimidazol-1-yl)-N-[(2S)-2-hydroxy-4-methylpentyl]pyridine-3-carboxamide
CID 97332340
6-(dimethylamino)-N-(2-hydroxy-4-methylpentyl)pyridine-3-carboxamide
CID 103771018
N-[(4-ethoxy-3-methylphenyl)methyl]-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 75499936
N-[1-(4-chlorophenyl)-1-hydroxypropan-2-yl]-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 110016437
3,5-dichloro-N-(2-hydroxy-4-methylpentyl)benzamide
CID 103770831
3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176504455
3-methyl-N-[2-[4-(trifluoromethyl)phenyl]ethyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 176503834

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide (CID 110013000) is N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide is CC(C)CC(O)CNC(=O)c1cnc2c(c1)ncn2C.
What is the InChIKey of N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is RICZBUJCXMDYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-9(2)4-11(19)7-16-14(20)10-5-12-13(15-6-10)18(3)8-17-12/h5-6,8-9,11,19H,4,7H2,1-3H3,(H,16,20).
What are the key properties of N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide?
N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylpentyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 110013000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).