1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine

C24H30FN — CID 70533722

IUPAC1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine
SMILESFc1ccc(C(=CCCc2ccccc2)CCCN2CCCCC2)cc1
InChIInChI=1S/C24H30FN/c25-24-16-14-23(15-17-24)22(12-7-11-21-9-3-1-4-10-21)13-8-20-26-18-5-2-6-19-26/h1,3-4,9-10,12,14-17H,2,5-8,11,13,18-20H2
InChIKeyCVYCPVLHECNIEM-UHFFFAOYSA-N
MW351.51 g/mol
LogP6.11
Rot. Bonds8

About 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine

1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine (PubChem CID 70533722) has the molecular formula C24H30FN and a molecular weight of 351.51 g/mol. Its IUPAC name is 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine.

Molecular Properties

Compound Name1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine
PubChem CID70533722
Molecular FormulaC24H30FN
Molecular Weight351.51 g/mol
Exact Mass351.24
IUPAC Name1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine
SMILESFc1ccc(C(=CCCc2ccccc2)CCCN2CCCCC2)cc1
InChIInChI=1S/C24H30FN/c25-24-16-14-23(15-17-24)22(12-7-11-21-9-3-1-4-10-21)13-8-20-26-18-5-2-6-19-26/h1,3-4,9-10,12,14-17H,2,5-8,11,13,18-20H2
InChIKeyCVYCPVLHECNIEM-UHFFFAOYSA-N
XLogP6.11
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.51
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-fluorophenyl)-5-phenyl-N-(3-piperidin-1-ylpropoxy)pentan-1-imine
CID 173415993
1-(11-phenylundecyl)piperidine;hydrochloride
CID 173446957
6-phenylhexan-1-ol;1-(6-phenylhexyl)piperidine
CID 23016534
1-[3-chloro-4,4-bis(4-fluorophenyl)but-3-enyl]piperidine
CID 110168451
4-fluoro-N-[1-(3-phenylpropyl)piperidin-4-yl]benzamide
CID 34799426
5-phenyl-1-[4-(3-piperidin-1-ylpropoxy)phenyl]pentan-1-one
CID 54372939
1-phenyl-5-piperidin-1-ylpentane-1,2-dione
CID 160870242
3-phenyl-N-(3-pyrrolidin-1-ylpropyl)propan-1-amine
CID 28658239
azepan-1-yl-[1-(3-phenylpropyl)piperidin-3-yl]methanone
CID 2930874
4-[C-(4-phenylbutyl)-N-(3-piperidin-1-ylpropoxy)carbonimidoyl]phenol
CID 173415956
1-[4-(4-fluorophenoxy)phenyl]-6-piperidin-1-ylhexan-1-one;hydrochloride
CID 70071282
1-[2-(4-fluorophenoxy)ethyl]-4-(3-phenylpropyl)piperazine;dihydrochloride
CID 67298873

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine?
The IUPAC name of 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine (CID 70533722) is 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine.
What is the SMILES notation for 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine?
The canonical SMILES for 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine is Fc1ccc(C(=CCCc2ccccc2)CCCN2CCCCC2)cc1.
What is the InChIKey of 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine?
The InChIKey is CVYCPVLHECNIEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30FN/c25-24-16-14-23(15-17-24)22(12-7-11-21-9-3-1-4-10-21)13-8-20-26-18-5-2-6-19-26/h1,3-4,9-10,12,14-17H,2,5-8,11,13,18-20H2.
What are the key properties of 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine?
1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine has a molecular weight of 351.51 g/mol, XLogP of 6.11, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-fluorophenyl)-7-phenylhept-4-enyl]piperidine is sourced from PubChem (CID 70533722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).