3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide

C25H23N5O2 — CID 97447191

IUPAC3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide
SMILESCc1ccc(CNC(=O)c2nc(-c3cn(Cc4ccccc4)c(C)n3)n3ccccc23)o1
InChIInChI=1S/C25H23N5O2/c1-17-11-12-20(32-17)14-26-25(31)23-22-10-6-7-13-30(22)24(28-23)21-16-29(18(2)27-21)15-19-8-4-3-5-9-19/h3-13,16H,14-15H2,1-2H3,(H,26,31)
InChIKeyMGKXCSVHMHOTQE-UHFFFAOYSA-N
MW425.49 g/mol
LogP4.39
Rot. Bonds6

About 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide

3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 97447191) has the molecular formula C25H23N5O2 and a molecular weight of 425.49 g/mol. Its IUPAC name is 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID97447191
Molecular FormulaC25H23N5O2
Molecular Weight425.49 g/mol
Exact Mass425.19
IUPAC Name3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide
SMILESCc1ccc(CNC(=O)c2nc(-c3cn(Cc4ccccc4)c(C)n3)n3ccccc23)o1
InChIInChI=1S/C25H23N5O2/c1-17-11-12-20(32-17)14-26-25(31)23-22-10-6-7-13-30(22)24(28-23)21-16-29(18(2)27-21)15-19-8-4-3-5-9-19/h3-13,16H,14-15H2,1-2H3,(H,26,31)
InChIKeyMGKXCSVHMHOTQE-UHFFFAOYSA-N
XLogP4.39
TPSA77.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.49
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(1-benzyl-2-methylimidazol-4-yl)-N-(2-pyridin-2-ylethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 97447189
3-(1-benzyl-2-methylimidazol-4-yl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 97447180
[3-(1-benzyl-2-methylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-pyrrolidin-1-ylmethanone
CID 97447183
[3-(1-benzyl-2-methylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-methylpiperazin-1-yl)methanone
CID 97447182
3-(1-benzylimidazol-4-yl)-N-(3-methoxypropyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 97361970
3-[1-[(2,4-difluorophenyl)methyl]-2-methylimidazol-4-yl]-N-(2-pyridin-4-ylethyl)imidazo[1,5-a]pyridine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 155857419
2-(4-benzyl-2,3-dioxoquinoxalin-1-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 46357271
3-[1-(2-methoxyethyl)imidazol-4-yl]-N-[(5-methylfuran-2-yl)methyl]indolizine-1-carboxamide
CID 97446920
N-[(4-chlorophenyl)methyl]-3-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 110648131
3-(1-benzylimidazol-4-yl)-N-[[(2R)-oxolan-2-yl]methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 97447006
4-[(4-benzyl-2,3-dioxopiperazin-1-yl)methyl]-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 53135627
3-N-benzyl-1-N-(furan-2-ylmethyl)-3-N-methylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070118

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide (CID 97447191) is 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide is Cc1ccc(CNC(=O)c2nc(-c3cn(Cc4ccccc4)c(C)n3)n3ccccc23)o1.
What is the InChIKey of 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is MGKXCSVHMHOTQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5O2/c1-17-11-12-20(32-17)14-26-25(31)23-22-10-6-7-13-30(22)24(28-23)21-16-29(18(2)27-21)15-19-8-4-3-5-9-19/h3-13,16H,14-15H2,1-2H3,(H,26,31).
What are the key properties of 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide?
3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 425.49 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzyl-2-methylimidazol-4-yl)-N-[(5-methylfuran-2-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 97447191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).