[4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone

C19H17F2N3O — CID 171627970

IUPAC[4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone
SMILESO=C(c1cccn2cncc12)N1CCC(c2ccc(F)c(F)c2)CC1
InChIInChI=1S/C19H17F2N3O/c20-16-4-3-14(10-17(16)21)13-5-8-23(9-6-13)19(25)15-2-1-7-24-12-22-11-18(15)24/h1-4,7,10-13H,5-6,8-9H2
InChIKeyXCELHGUUVMONKD-UHFFFAOYSA-N
MW341.36 g/mol
LogP3.63
Rot. Bonds2

About [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone

[4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone (PubChem CID 171627970) has the molecular formula C19H17F2N3O and a molecular weight of 341.36 g/mol. Its IUPAC name is [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone.

Molecular Properties

Compound Name[4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone
PubChem CID171627970
Molecular FormulaC19H17F2N3O
Molecular Weight341.36 g/mol
Exact Mass341.13
IUPAC Name[4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone
SMILESO=C(c1cccn2cncc12)N1CCC(c2ccc(F)c(F)c2)CC1
InChIInChI=1S/C19H17F2N3O/c20-16-4-3-14(10-17(16)21)13-5-8-23(9-6-13)19(25)15-2-1-7-24-12-22-11-18(15)24/h1-4,7,10-13H,5-6,8-9H2
InChIKeyXCELHGUUVMONKD-UHFFFAOYSA-N
XLogP3.63
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.36
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[1-(3-ethoxy-2,4,5-trifluorobenzoyl)piperidin-4-yl]phenyl]imidazo[1,5-a]pyridine-8-carboxamide
CID 171683788
N-[(3S,4S)-4-(3,5-difluorophenyl)-1-(imidazo[1,5-a]pyridine-8-carbonyl)piperidin-3-yl]-2,2-difluoroacetamide
CID 171628250
(2R)-N-[(3S,4S)-4-(3,5-difluorophenyl)-1-(imidazo[1,5-a]pyridine-8-carbonyl)piperidin-3-yl]-1-methylpiperidine-2-carboxamide
CID 171628073
(2-fluorophenyl)-[4-[3-(pyrrolidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]methanone
CID 50848538
2-chloro-1-[4-(3,4-difluorophenyl)piperidin-1-yl]ethanone
CID 166403888
(2-fluorophenyl)-[4-[3-(4-methylpiperidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]methanone
CID 50848974
5-[4-(3,4-difluorophenyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 122136984
N-[(3S,4S)-1-(imidazo[1,5-a]pyridine-8-carbonyl)-4-phenylpiperidin-3-yl]-3-methylbutanamide
CID 171628120
N-[(3S)-1-(imidazo[1,5-a]pyridine-8-carbonyl)piperidin-3-yl]-2-pyrrolidin-1-ylacetamide
CID 171627868
(2R)-N-[(3S,4S)-4-(3-chloro-5-fluorophenyl)-1-(imidazo[1,5-a]pyridine-8-carbonyl)piperidin-3-yl]-3-methyl-2-[(2,2,2-trifluoroacetyl)amino]butanamide
CID 171628213
[4-(3,4-difluorophenyl)piperidin-1-yl]-[(2S,4S)-4-methoxypyrrolidin-2-yl]methanone;hydrochloride
CID 128979468
(2R)-N-[(3S,4S)-4-(3,5-difluorophenyl)-1-(imidazo[1,5-a]pyridine-8-carbonyl)piperidin-3-yl]-2-propan-2-ylpyrrolidine-2-carboxamide
CID 171628048

Frequently Asked Questions

What is the IUPAC name of [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone?
The IUPAC name of [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone (CID 171627970) is [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone.
What is the SMILES notation for [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone?
The canonical SMILES for [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone is O=C(c1cccn2cncc12)N1CCC(c2ccc(F)c(F)c2)CC1.
What is the InChIKey of [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone?
The InChIKey is XCELHGUUVMONKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2N3O/c20-16-4-3-14(10-17(16)21)13-5-8-23(9-6-13)19(25)15-2-1-7-24-12-22-11-18(15)24/h1-4,7,10-13H,5-6,8-9H2.
What are the key properties of [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone?
[4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone has a molecular weight of 341.36 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3,4-difluorophenyl)piperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone is sourced from PubChem (CID 171627970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).