N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide

C21H19N5O2 — CID 53020605

IUPACN-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide
SMILESCOc1cccc(Cn2c(CNC(=O)c3cccnc3)nc3cccnc32)c1
InChIInChI=1S/C21H19N5O2/c1-28-17-7-2-5-15(11-17)14-26-19(25-18-8-4-10-23-20(18)26)13-24-21(27)16-6-3-9-22-12-16/h2-12H,13-14H2,1H3,(H,24,27)
InChIKeyRHWKWCYXYKXCSQ-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.81
Rot. Bonds6

About N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide

N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide (PubChem CID 53020605) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide
PubChem CID53020605
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC NameN-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide
SMILESCOc1cccc(Cn2c(CNC(=O)c3cccnc3)nc3cccnc32)c1
InChIInChI=1S/C21H19N5O2/c1-28-17-7-2-5-15(11-17)14-26-19(25-18-8-4-10-23-20(18)26)13-24-21(27)16-6-3-9-22-12-16/h2-12H,13-14H2,1H3,(H,24,27)
InChIKeyRHWKWCYXYKXCSQ-UHFFFAOYSA-N
XLogP2.81
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide with MolForge

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Related Compounds

3-methoxy-N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]benzamide
CID 53020588
2-(3-methoxyphenyl)-N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]acetamide
CID 53020568
N-[[3-(2-methoxyethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(3-methoxyphenyl)acetamide
CID 53022337
4-benzyl-N-[(3-methoxyphenyl)methyl]-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 134798321
3-[(3-methoxyphenyl)methyl]-2-methylimidazo[4,5-b]pyridine
CID 117166254
N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-2,4-dimethylbenzenesulfonamide
CID 53022402
N-[(3-benzylimidazo[4,5-b]pyridin-2-yl)methyl]-3-methoxybenzenesulfonamide
CID 53022613
3,4-diethoxy-N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]benzamide
CID 53022332
N-[(3-methoxyphenyl)methyl]-3-(3-propylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 46256846
2-(3-methoxyphenyl)-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]acetamide
CID 53143714
4-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(3-methoxyphenyl)butanamide
CID 46360040
N-[(3-fluorophenyl)methyl]-3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]propanamide
CID 122445601

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide?
The IUPAC name of N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide (CID 53020605) is N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide?
The canonical SMILES for N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide is COc1cccc(Cn2c(CNC(=O)c3cccnc3)nc3cccnc32)c1.
What is the InChIKey of N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide?
The InChIKey is RHWKWCYXYKXCSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c1-28-17-7-2-5-15(11-17)14-26-19(25-18-8-4-10-23-20(18)26)13-24-21(27)16-6-3-9-22-12-16/h2-12H,13-14H2,1H3,(H,24,27).
What are the key properties of N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide?
N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide has a molecular weight of 373.42 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 53020605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).