4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine

C23H29N — CID 70259114

IUPAC4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine
SMILESc1ccc(C2CCN(CC3CCCC3c3ccccc3)CC2)cc1
InChIInChI=1S/C23H29N/c1-3-8-19(9-4-1)20-14-16-24(17-15-20)18-22-12-7-13-23(22)21-10-5-2-6-11-21/h1-6,8-11,20,22-23H,7,12-18H2
InChIKeyYARDHMPZYBZHET-UHFFFAOYSA-N
MW319.49 g/mol
LogP5.45
Rot. Bonds4

About 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine

4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine (PubChem CID 70259114) has the molecular formula C23H29N and a molecular weight of 319.49 g/mol. Its IUPAC name is 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine.

Molecular Properties

Compound Name4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine
PubChem CID70259114
Molecular FormulaC23H29N
Molecular Weight319.49 g/mol
Exact Mass319.23
IUPAC Name4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine
SMILESc1ccc(C2CCN(CC3CCCC3c3ccccc3)CC2)cc1
InChIInChI=1S/C23H29N/c1-3-8-19(9-4-1)20-14-16-24(17-15-20)18-22-12-7-13-23(22)21-10-5-2-6-11-21/h1-6,8-11,20,22-23H,7,12-18H2
InChIKeyYARDHMPZYBZHET-UHFFFAOYSA-N
XLogP5.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.49
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

trans-(1S,2S)-2-[(4-phenylpiperidin-1-yl)methyl]cyclohexan-1-ol
CID 70691042
1-[(1-benzyl-4-phenylpyrrolidin-3-yl)methyl]-4-phenylpiperidine
CID 22116082
[(1R,2S)-2-[(4-phenylpiperidin-1-yl)methyl]cyclohexyl]carbamic acid
CID 141194204
N-ethyl-2-[(3-phenylpyrrolidin-1-yl)methyl]cyclopentan-1-amine
CID 62615234
[2-methyl-1-[(1S,2R)-2-[(4-phenylpiperidin-1-yl)methyl]cyclohexyl]propan-2-yl] carbamate
CID 174592824
[3-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl]-pyridin-4-ylmethanone
CID 70203150
[3-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl]-[2-(trifluoromethyl)phenyl]methanone
CID 70272512
2-[4-((1,2,3,4,5,6-13C6)cyclohexatrienyl)(3,4,5-13C3)azinan-1-yl]-1,1,2,2-tetradeuterio(113C)ethanamine
CID 89308417
1-(2-chloroethyl)-4-phenylpiperidine
CID 13195407
(4-methylphenyl)-[3-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl]methanone
CID 70200360
4-phenyl-1-(piperidin-4-ylmethyl)azepane;hydrochloride
CID 119931344
[(1R,2R)-2-(chloromethyl)cyclohexyl]benzene
CID 130762341

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine?
The IUPAC name of 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine (CID 70259114) is 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine.
What is the SMILES notation for 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine?
The canonical SMILES for 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine is c1ccc(C2CCN(CC3CCCC3c3ccccc3)CC2)cc1.
What is the InChIKey of 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine?
The InChIKey is YARDHMPZYBZHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N/c1-3-8-19(9-4-1)20-14-16-24(17-15-20)18-22-12-7-13-23(22)21-10-5-2-6-11-21/h1-6,8-11,20,22-23H,7,12-18H2.
What are the key properties of 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine?
4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine has a molecular weight of 319.49 g/mol, XLogP of 5.45, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1-[(2-phenylcyclopentyl)methyl]piperidine is sourced from PubChem (CID 70259114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).