1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine

C22H26N2 — CID 15946547

IUPAC1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine
SMILESc1ccc(N2CCC(=C3CCN(c4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C22H26N2/c1-3-7-21(8-4-1)23-15-11-19(12-16-23)20-13-17-24(18-14-20)22-9-5-2-6-10-22/h1-10H,11-18H2
InChIKeyPSHAIEFJBWDTMW-UHFFFAOYSA-N
MW318.46 g/mol
LogP4.88
Rot. Bonds2

About 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine

1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine (PubChem CID 15946547) has the molecular formula C22H26N2 and a molecular weight of 318.46 g/mol. Its IUPAC name is 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine.

Molecular Properties

Compound Name1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine
PubChem CID15946547
Molecular FormulaC22H26N2
Molecular Weight318.46 g/mol
Exact Mass318.21
IUPAC Name1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine
SMILESc1ccc(N2CCC(=C3CCN(c4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C22H26N2/c1-3-7-21(8-4-1)23-15-11-19(12-16-23)20-13-17-24(18-14-20)22-9-5-2-6-10-22/h1-10H,11-18H2
InChIKeyPSHAIEFJBWDTMW-UHFFFAOYSA-N
XLogP4.88
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-methylidene-1-phenylpiperidine
CID 58902724
2-[4-[4-(1-phenylpiperidin-4-ylidene)cyclohexylidene]cyclohexylidene]propanedinitrile
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1-fluoro-4-phenylpiperazine
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2-phenyl-3,4-dihydro-1H-isoquinoline
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2-(1-phenylpiperidin-4-ylidene)acetonitrile
CID 67046254
2-phenyl-3,4-dihydro-1H-isoquinoline;hydrochloride
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1-methanidyl-4-phenylpiperazin-1-ium
CID 20723217
ethane;methanol;1-phenylpiperidine
CID 177175072
1-(4-phenylphenyl)aziridine
CID 152682568
1-[4-(4-phenylpiperazin-1-yl)phenyl]ethanamine
CID 43188772
3-phenyl-1,3-oxazinan-6-one
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1-cycloheptyl-4-phenylpiperazine
CID 2846720

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine?
The IUPAC name of 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine (CID 15946547) is 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine.
What is the SMILES notation for 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine?
The canonical SMILES for 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine is c1ccc(N2CCC(=C3CCN(c4ccccc4)CC3)CC2)cc1.
What is the InChIKey of 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine?
The InChIKey is PSHAIEFJBWDTMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2/c1-3-7-21(8-4-1)23-15-11-19(12-16-23)20-13-17-24(18-14-20)22-9-5-2-6-10-22/h1-10H,11-18H2.
What are the key properties of 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine?
1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine has a molecular weight of 318.46 g/mol, XLogP of 4.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-4-(1-phenylpiperidin-4-ylidene)piperidine is sourced from PubChem (CID 15946547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).