4-(4-ethylphenyl)-1-propan-2-ylpiperidine

C16H25N — CID 69073931

IUPAC4-(4-ethylphenyl)-1-propan-2-ylpiperidine
SMILESCCc1ccc(C2CCN(C(C)C)CC2)cc1
InChIInChI=1S/C16H25N/c1-4-14-5-7-15(8-6-14)16-9-11-17(12-10-16)13(2)3/h5-8,13,16H,4,9-12H2,1-3H3
InChIKeyALMNSJRRRWFFSP-UHFFFAOYSA-N
MW231.38 g/mol
LogP3.84
Rot. Bonds3

About 4-(4-ethylphenyl)-1-propan-2-ylpiperidine

4-(4-ethylphenyl)-1-propan-2-ylpiperidine (PubChem CID 69073931) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 4-(4-ethylphenyl)-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4-(4-ethylphenyl)-1-propan-2-ylpiperidine
PubChem CID69073931
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name4-(4-ethylphenyl)-1-propan-2-ylpiperidine
SMILESCCc1ccc(C2CCN(C(C)C)CC2)cc1
InChIInChI=1S/C16H25N/c1-4-14-5-7-15(8-6-14)16-9-11-17(12-10-16)13(2)3/h5-8,13,16H,4,9-12H2,1-3H3
InChIKeyALMNSJRRRWFFSP-UHFFFAOYSA-N
XLogP3.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-(4-ethylphenyl)-1-propan-2-ylpiperidine 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-(4-ethylphenyl)-1-propan-2-ylpiperidine?
The IUPAC name of 4-(4-ethylphenyl)-1-propan-2-ylpiperidine (CID 69073931) is 4-(4-ethylphenyl)-1-propan-2-ylpiperidine.
What is the SMILES notation for 4-(4-ethylphenyl)-1-propan-2-ylpiperidine?
The canonical SMILES for 4-(4-ethylphenyl)-1-propan-2-ylpiperidine is CCc1ccc(C2CCN(C(C)C)CC2)cc1.
What is the InChIKey of 4-(4-ethylphenyl)-1-propan-2-ylpiperidine?
The InChIKey is ALMNSJRRRWFFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-4-14-5-7-15(8-6-14)16-9-11-17(12-10-16)13(2)3/h5-8,13,16H,4,9-12H2,1-3H3.
What are the key properties of 4-(4-ethylphenyl)-1-propan-2-ylpiperidine?
4-(4-ethylphenyl)-1-propan-2-ylpiperidine has a molecular weight of 231.38 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylphenyl)-1-propan-2-ylpiperidine is sourced from PubChem (CID 69073931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).