5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide

C16H16N4O — CID 167680894

IUPAC5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide
SMILESCc1ccc2c(ncn2C(=O)NCCc2ccccc2)n1
InChIInChI=1S/C16H16N4O/c1-12-7-8-14-15(19-12)18-11-20(14)16(21)17-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,17,21)
InChIKeyVNGZDIYSWGYKPO-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.54
Rot. Bonds3

About 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide

5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide (PubChem CID 167680894) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide
PubChem CID167680894
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide
SMILESCc1ccc2c(ncn2C(=O)NCCc2ccccc2)n1
InChIInChI=1S/C16H16N4O/c1-12-7-8-14-15(19-12)18-11-20(14)16(21)17-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,17,21)
InChIKeyVNGZDIYSWGYKPO-UHFFFAOYSA-N
XLogP2.54
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(2-phenylethyl)benzimidazole-1-carboxamide
CID 167679804
4-(4-methylpiperazin-1-yl)-N-(2-phenylethyl)benzimidazole-1-carboxamide
CID 156708014
1-(6-methyl-2-pyridinyl)-3-(2-phenylethyl)urea
CID 108888073
3-[(6-methyl-2-pyridinyl)oxy]-N-(2-phenylethyl)azetidine-1-carboxamide
CID 122249689
2-phenylethylcarbamothioic S-acid
CID 11116669
molecular hydrogen;2-phenylethylcarbamic acid
CID 145072858
2-[5-[(dimethylamino)methyl]-3-pyridinyl]-N-(2-phenylethyl)imidazole-1-carboxamide
CID 175765380
4-cyclopropyl-2-methoxy-N-(2-phenylethyl)imidazole-1-carboxamide
CID 156708302
4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-(3-phenylpropyl)benzimidazole-1-carboxamide
CID 166046436
4-(1-methylpyrrolidin-3-yl)-N-(3-phenylpropyl)benzimidazole-1-carboxamide
CID 156708196
2-hydroxy-2-methyl-N-(2-phenylethyl)propanamide
CID 71525164
2-methyl-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 84576023

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide?
The IUPAC name of 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide (CID 167680894) is 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide?
The canonical SMILES for 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide is Cc1ccc2c(ncn2C(=O)NCCc2ccccc2)n1.
What is the InChIKey of 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide?
The InChIKey is VNGZDIYSWGYKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-12-7-8-14-15(19-12)18-11-20(14)16(21)17-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,17,21).
What are the key properties of 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide?
5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-1-carboxamide is sourced from PubChem (CID 167680894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).