1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine

C20H22FN3 — CID 92564228

IUPAC1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine
SMILESCc1nc([C@H]2CCCN(Cc3ccccc3F)C2)c2ccccn12
InChIInChI=1S/C20H22FN3/c1-15-22-20(19-10-4-5-12-24(15)19)17-8-6-11-23(14-17)13-16-7-2-3-9-18(16)21/h2-5,7,9-10,12,17H,6,8,11,13-14H2,1H3/t17-/m0/s1
InChIKeyIUDHUCXNBOUHGX-KRWDZBQOSA-N
MW323.41 g/mol
LogP4.16
Rot. Bonds3

About 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine

1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine (PubChem CID 92564228) has the molecular formula C20H22FN3 and a molecular weight of 323.41 g/mol. Its IUPAC name is 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine
PubChem CID92564228
Molecular FormulaC20H22FN3
Molecular Weight323.41 g/mol
Exact Mass323.18
IUPAC Name1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine
SMILESCc1nc([C@H]2CCCN(Cc3ccccc3F)C2)c2ccccn12
InChIInChI=1S/C20H22FN3/c1-15-22-20(19-10-4-5-12-24(15)19)17-8-6-11-23(14-17)13-16-7-2-3-9-18(16)21/h2-5,7,9-10,12,17H,6,8,11,13-14H2,1H3/t17-/m0/s1
InChIKeyIUDHUCXNBOUHGX-KRWDZBQOSA-N
XLogP4.16
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.41
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-2-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 46960716
2-[3-[1-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]piperidin-3-yl]pyrazol-1-yl]ethanol
CID 119073447
4-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]pyrimidine
CID 110096175
1-[(2-fluorophenyl)methyl]-3-methoxypiperidine
CID 136523280
4-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-2-methyl-6-(5-methyl-1H-imidazol-2-yl)pyrimidine
CID 110109889
3-[4-(2,6-difluorophenyl)-1H-pyrazol-5-yl]-1-[(2-fluorophenyl)methyl]piperidine
CID 45218502
2-[(2-fluorophenyl)methyl]-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 49234263
1-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]ethanone
CID 63846661
3-methyl-1-[[(3S)-3-[(2-methylimidazol-1-yl)methyl]piperidin-1-yl]methyl]imidazo[1,5-a]pyridine
CID 95707908
N-cyclohexyl-2-[2-[(3R)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-4,6-dimethylpyrimidin-5-yl]acetamide
CID 125021463
2-[(3S)-1-[(2-fluorophenyl)methyl]pyrrolidin-3-yl]-4-methylpyrimidine
CID 124953007
2-[(3R)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-1H-pyrrolo[2,3-b]pyridine
CID 92572827

Frequently Asked Questions

What is the IUPAC name of 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine?
The IUPAC name of 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine (CID 92564228) is 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine?
The canonical SMILES for 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine is Cc1nc([C@H]2CCCN(Cc3ccccc3F)C2)c2ccccn12.
What is the InChIKey of 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine?
The InChIKey is IUDHUCXNBOUHGX-KRWDZBQOSA-N. The full InChI is InChI=1S/C20H22FN3/c1-15-22-20(19-10-4-5-12-24(15)19)17-8-6-11-23(14-17)13-16-7-2-3-9-18(16)21/h2-5,7,9-10,12,17H,6,8,11,13-14H2,1H3/t17-/m0/s1.
What are the key properties of 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine?
1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine has a molecular weight of 323.41 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-methylimidazo[1,5-a]pyridine is sourced from PubChem (CID 92564228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).