2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one

C19H17N5O — CID 134690296

IUPAC2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one
SMILESCC(C)C(=O)c1nc(-c2cn(-c3ccccn3)cn2)n2ccccc12
InChIInChI=1S/C19H17N5O/c1-13(2)18(25)17-15-7-4-6-10-24(15)19(22-17)14-11-23(12-21-14)16-8-3-5-9-20-16/h3-13H,1-2H3
InChIKeyPLKAOHJSUCUDFE-UHFFFAOYSA-N
MW331.38 g/mol
LogP3.42
Rot. Bonds4

About 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one

2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one (PubChem CID 134690296) has the molecular formula C19H17N5O and a molecular weight of 331.38 g/mol. Its IUPAC name is 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one.

Molecular Properties

Compound Name2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one
PubChem CID134690296
Molecular FormulaC19H17N5O
Molecular Weight331.38 g/mol
Exact Mass331.14
IUPAC Name2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one
SMILESCC(C)C(=O)c1nc(-c2cn(-c3ccccn3)cn2)n2ccccc12
InChIInChI=1S/C19H17N5O/c1-13(2)18(25)17-15-7-4-6-10-24(15)19(22-17)14-11-23(12-21-14)16-8-3-5-9-20-16/h3-13H,1-2H3
InChIKeyPLKAOHJSUCUDFE-UHFFFAOYSA-N
XLogP3.42
TPSA65.08 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(4-methyl-1,4-diazepan-1-yl)-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]methanone
CID 97447078
3-(1-propan-2-ylimidazol-4-yl)-N-pyridin-3-ylimidazo[1,5-a]pyridine-1-carboxamide
CID 97447003
3-(1-phenylimidazol-4-yl)-N-(2-pyridin-3-ylethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 97447063
3-(1-methylpyrrol-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 82477425
1-[3,5-bis(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)phenyl]-3-pyridin-2-ylimidazo[1,5-a]pyridine
CID 118322669
N-pyridin-3-yl-3-[1-(1,3-thiazol-2-yl)imidazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 155843446
3-(1-benzylimidazol-4-yl)-N-(3-methoxypropyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 97361970
[3-(4-methoxyphenyl)imidazo[1,5-a]pyridin-1-yl]-pyridin-2-ylmethanone
CID 11023969
3-(1-benzyl-2-methylimidazol-4-yl)-N-(2-pyridin-2-ylethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 97447189
[3-(1-benzylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 97447020
3-(4-fluorophenyl)-N-[(1S)-2,2,2-trifluoro-1-pyridin-2-ylethyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 58023866
[3-(1-cyclopentylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]-(4-phenylpiperazin-1-yl)methanone
CID 97447152

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one?
The IUPAC name of 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one (CID 134690296) is 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one.
What is the SMILES notation for 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one?
The canonical SMILES for 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one is CC(C)C(=O)c1nc(-c2cn(-c3ccccn3)cn2)n2ccccc12.
What is the InChIKey of 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one?
The InChIKey is PLKAOHJSUCUDFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O/c1-13(2)18(25)17-15-7-4-6-10-24(15)19(22-17)14-11-23(12-21-14)16-8-3-5-9-20-16/h3-13H,1-2H3.
What are the key properties of 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one?
2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one has a molecular weight of 331.38 g/mol, XLogP of 3.42, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[3-(1-pyridin-2-ylimidazol-4-yl)imidazo[1,5-a]pyridin-1-yl]propan-1-one is sourced from PubChem (CID 134690296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).