1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine

C21H23F2N3 — CID 134154730

IUPAC1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine
SMILESFC1(F)CCN(Cc2ncn3ccccc23)CC1CCc1ccccc1
InChIInChI=1S/C21H23F2N3/c22-21(23)11-13-25(14-18(21)10-9-17-6-2-1-3-7-17)15-19-20-8-4-5-12-26(20)16-24-19/h1-8,12,16,18H,9-11,13-15H2
InChIKeyCHAVLJINZHBAED-UHFFFAOYSA-N
MW355.43 g/mol
LogP4.42
Rot. Bonds5

About 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine

1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine (PubChem CID 134154730) has the molecular formula C21H23F2N3 and a molecular weight of 355.43 g/mol. Its IUPAC name is 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine
PubChem CID134154730
Molecular FormulaC21H23F2N3
Molecular Weight355.43 g/mol
Exact Mass355.19
IUPAC Name1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine
SMILESFC1(F)CCN(Cc2ncn3ccccc23)CC1CCc1ccccc1
InChIInChI=1S/C21H23F2N3/c22-21(23)11-13-25(14-18(21)10-9-17-6-2-1-3-7-17)15-19-20-8-4-5-12-26(20)16-24-19/h1-8,12,16,18H,9-11,13-15H2
InChIKeyCHAVLJINZHBAED-UHFFFAOYSA-N
XLogP4.42
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.43
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine with MolForge

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Related Compounds

3,7-dichloro-2-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]quinoline
CID 134135129
2-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]benzonitrile
CID 134142152
4,4-difluoro-3-(2-phenylethyl)-1-[[4-(trifluoromethoxy)phenyl]methyl]piperidine
CID 134141837
3-[[(3S)-4,4-difluoro-3-[2-(4-fluorophenyl)ethyl]piperidin-1-yl]methyl]-6-methoxy-1H-indole
CID 134137565
2-(1-benzyl-4,4-dimethylpiperidin-3-yl)ethanol
CID 117025569
(8-benzyl-8-azaspiro[4.5]decan-10-yl)methanol
CID 22495756
N-(imidazo[1,5-a]pyridin-1-ylmethyl)propan-1-amine
CID 167286765
(3S,5R)-1-benzyl-4,4-difluoro-5-(hydroxymethyl)piperidin-3-ol
CID 42612420
6-benzyl-6-azaspiro[2.5]octan-8-ol
CID 66783213
2-[(3R,5S)-1-benzyl-4,4-difluoro-5-methylpiperidin-3-yl]ethanol
CID 167458365
2-[[4-methoxy-4-(2-phenylethyl)piperidin-1-yl]methyl]-3-[(2-methylpropan-2-yl)oxy]pyrazine
CID 174479392
4-imidazo[1,5-a]pyridin-1-ylbut-3-enoic acid
CID 54407536

Frequently Asked Questions

What is the IUPAC name of 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine?
The IUPAC name of 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine (CID 134154730) is 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine.
What is the SMILES notation for 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine?
The canonical SMILES for 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine is FC1(F)CCN(Cc2ncn3ccccc23)CC1CCc1ccccc1.
What is the InChIKey of 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine?
The InChIKey is CHAVLJINZHBAED-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23F2N3/c22-21(23)11-13-25(14-18(21)10-9-17-6-2-1-3-7-17)15-19-20-8-4-5-12-26(20)16-24-19/h1-8,12,16,18H,9-11,13-15H2.
What are the key properties of 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine?
1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine has a molecular weight of 355.43 g/mol, XLogP of 4.42, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4,4-difluoro-3-(2-phenylethyl)piperidin-1-yl]methyl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 134154730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).