4-(1-phenylcyclopentyl)piperidine

C16H23N — CID 83911457

IUPAC4-(1-phenylcyclopentyl)piperidine
SMILESc1ccc(C2(C3CCNCC3)CCCC2)cc1
InChIInChI=1S/C16H23N/c1-2-6-14(7-3-1)16(10-4-5-11-16)15-8-12-17-13-9-15/h1-3,6-7,15,17H,4-5,8-13H2
InChIKeyXCYONIIIUFRGFR-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.50
Rot. Bonds2

About 4-(1-phenylcyclopentyl)piperidine

4-(1-phenylcyclopentyl)piperidine (PubChem CID 83911457) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is 4-(1-phenylcyclopentyl)piperidine.

Molecular Properties

Compound Name4-(1-phenylcyclopentyl)piperidine
PubChem CID83911457
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name4-(1-phenylcyclopentyl)piperidine
SMILESc1ccc(C2(C3CCNCC3)CCCC2)cc1
InChIInChI=1S/C16H23N/c1-2-6-14(7-3-1)16(10-4-5-11-16)15-8-12-17-13-9-15/h1-3,6-7,15,17H,4-5,8-13H2
InChIKeyXCYONIIIUFRGFR-UHFFFAOYSA-N
XLogP3.50
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(1-phenylcyclopentyl)piperidine?
The IUPAC name of 4-(1-phenylcyclopentyl)piperidine (CID 83911457) is 4-(1-phenylcyclopentyl)piperidine.
What is the SMILES notation for 4-(1-phenylcyclopentyl)piperidine?
The canonical SMILES for 4-(1-phenylcyclopentyl)piperidine is c1ccc(C2(C3CCNCC3)CCCC2)cc1.
What is the InChIKey of 4-(1-phenylcyclopentyl)piperidine?
The InChIKey is XCYONIIIUFRGFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-2-6-14(7-3-1)16(10-4-5-11-16)15-8-12-17-13-9-15/h1-3,6-7,15,17H,4-5,8-13H2.
What are the key properties of 4-(1-phenylcyclopentyl)piperidine?
4-(1-phenylcyclopentyl)piperidine has a molecular weight of 229.37 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-phenylcyclopentyl)piperidine is sourced from PubChem (CID 83911457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).