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

C20H18N4O2 — CID 53022329

IUPACN-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide
SMILESCc1ccc(Cn2c(CNC(=O)c3ccco3)nc3cccnc32)cc1
InChIInChI=1S/C20H18N4O2/c1-14-6-8-15(9-7-14)13-24-18(23-16-4-2-10-21-19(16)24)12-22-20(25)17-5-3-11-26-17/h2-11H,12-13H2,1H3,(H,22,25)
InChIKeyKIMBUNDGVIJVQB-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.31
Rot. Bonds5

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

N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide (PubChem CID 53022329) has the molecular formula C20H18N4O2 and a molecular weight of 346.39 g/mol. Its IUPAC name is N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide
PubChem CID53022329
Molecular FormulaC20H18N4O2
Molecular Weight346.39 g/mol
Exact Mass346.14
IUPAC NameN-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide
SMILESCc1ccc(Cn2c(CNC(=O)c3ccco3)nc3cccnc32)cc1
InChIInChI=1S/C20H18N4O2/c1-14-6-8-15(9-7-14)13-24-18(23-16-4-2-10-21-19(16)24)12-22-20(25)17-5-3-11-26-17/h2-11H,12-13H2,1H3,(H,22,25)
InChIKeyKIMBUNDGVIJVQB-UHFFFAOYSA-N
XLogP3.31
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[3-(2-methoxyethyl)imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide
CID 53013036
3,4-diethoxy-N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]benzamide
CID 53022332
2-(3-methoxyphenyl)-N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]acetamide
CID 53020568
N-[(3-benzylimidazo[4,5-b]pyridin-2-yl)methyl]-2-methylpropanamide
CID 53020555
N-[(3-benzylimidazo[4,5-b]pyridin-2-yl)methyl]thiophene-2-carboxamide
CID 53022323
N-(furan-2-ylmethyl)-4-[4-[(4-methylphenyl)methyl]-3-oxopyrido[2,3-b]pyrazin-2-yl]piperazine-1-carboxamide
CID 53069995
N-[2-(2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)ethyl]furan-2-carboxamide
CID 53021795
2-chloro-N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]benzenesulfonamide
CID 53020666
3-methoxy-N-[[3-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]benzamide
CID 53020588
N-[2-(furan-2-yl)ethyl]-1-[4-[(4-methylphenyl)methyl]-3-oxopyrido[2,3-b]pyrazin-2-yl]piperidine-4-carboxamide
CID 46324860
N-[[3-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-4-nitrobenzamide
CID 53022362
N-[2-(4-chlorophenyl)ethyl]-4-[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]butanamide
CID 46360101

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide?
The IUPAC name of N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide (CID 53022329) is N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide.
What is the SMILES notation for N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide?
The canonical SMILES for N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide is Cc1ccc(Cn2c(CNC(=O)c3ccco3)nc3cccnc32)cc1.
What is the InChIKey of N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide?
The InChIKey is KIMBUNDGVIJVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O2/c1-14-6-8-15(9-7-14)13-24-18(23-16-4-2-10-21-19(16)24)12-22-20(25)17-5-3-11-26-17/h2-11H,12-13H2,1H3,(H,22,25).
What are the key properties of N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide?
N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide has a molecular weight of 346.39 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]furan-2-carboxamide is sourced from PubChem (CID 53022329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).