4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine

C20H25N — CID 79432342

IUPAC4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine
SMILESCCc1ccccc1C1CCNCC1c1ccc(C)cc1
InChIInChI=1S/C20H25N/c1-3-16-6-4-5-7-18(16)19-12-13-21-14-20(19)17-10-8-15(2)9-11-17/h4-11,19-21H,3,12-14H2,1-2H3
InChIKeyVCZXETJDYJLAGV-UHFFFAOYSA-N
MW279.43 g/mol
LogP4.42
Rot. Bonds3

About 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine

4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine (PubChem CID 79432342) has the molecular formula C20H25N and a molecular weight of 279.43 g/mol. Its IUPAC name is 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine.

Molecular Properties

Compound Name4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine
PubChem CID79432342
Molecular FormulaC20H25N
Molecular Weight279.43 g/mol
Exact Mass279.20
IUPAC Name4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine
SMILESCCc1ccccc1C1CCNCC1c1ccc(C)cc1
InChIInChI=1S/C20H25N/c1-3-16-6-4-5-7-18(16)19-12-13-21-14-20(19)17-10-8-15(2)9-11-17/h4-11,19-21H,3,12-14H2,1-2H3
InChIKeyVCZXETJDYJLAGV-UHFFFAOYSA-N
XLogP4.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-(2-ethylphenyl)-3-(4-methylphenyl)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 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine?
The IUPAC name of 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine (CID 79432342) is 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine.
What is the SMILES notation for 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine?
The canonical SMILES for 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine is CCc1ccccc1C1CCNCC1c1ccc(C)cc1.
What is the InChIKey of 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine?
The InChIKey is VCZXETJDYJLAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N/c1-3-16-6-4-5-7-18(16)19-12-13-21-14-20(19)17-10-8-15(2)9-11-17/h4-11,19-21H,3,12-14H2,1-2H3.
What are the key properties of 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine?
4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine has a molecular weight of 279.43 g/mol, XLogP of 4.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine is sourced from PubChem (CID 79432342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).