1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine

C18H27N — CID 145201181

IUPAC1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine
SMILESCc1ccc(C2CCN(C3CCCC3)CC2)c(C)c1
InChIInChI=1S/C18H27N/c1-14-7-8-18(15(2)13-14)16-9-11-19(12-10-16)17-5-3-4-6-17/h7-8,13,16-17H,3-6,9-12H2,1-2H3
InChIKeyPDHKTSYDJQADRP-UHFFFAOYSA-N
MW257.42 g/mol
LogP4.43
Rot. Bonds2

About 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine

1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine (PubChem CID 145201181) has the molecular formula C18H27N and a molecular weight of 257.42 g/mol. Its IUPAC name is 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine.

Molecular Properties

Compound Name1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine
PubChem CID145201181
Molecular FormulaC18H27N
Molecular Weight257.42 g/mol
Exact Mass257.21
IUPAC Name1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine
SMILESCc1ccc(C2CCN(C3CCCC3)CC2)c(C)c1
InChIInChI=1S/C18H27N/c1-14-7-8-18(15(2)13-14)16-9-11-19(12-10-16)17-5-3-4-6-17/h7-8,13,16-17H,3-6,9-12H2,1-2H3
InChIKeyPDHKTSYDJQADRP-UHFFFAOYSA-N
XLogP4.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine?
The IUPAC name of 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine (CID 145201181) is 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine.
What is the SMILES notation for 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine?
The canonical SMILES for 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine is Cc1ccc(C2CCN(C3CCCC3)CC2)c(C)c1.
What is the InChIKey of 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine?
The InChIKey is PDHKTSYDJQADRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N/c1-14-7-8-18(15(2)13-14)16-9-11-19(12-10-16)17-5-3-4-6-17/h7-8,13,16-17H,3-6,9-12H2,1-2H3.
What are the key properties of 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine?
1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine has a molecular weight of 257.42 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-(2,4-dimethylphenyl)piperidine is sourced from PubChem (CID 145201181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).