2-ethyl-1-(4-methylphenyl)piperidine

C14H21N — CID 90712958

IUPAC2-ethyl-1-(4-methylphenyl)piperidine
SMILESCCC1CCCCN1c1ccc(C)cc1
InChIInChI=1S/C14H21N/c1-3-13-6-4-5-11-15(13)14-9-7-12(2)8-10-14/h7-10,13H,3-6,11H2,1-2H3
InChIKeyWLCWTWVBTKASSJ-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.76
Rot. Bonds2

About 2-ethyl-1-(4-methylphenyl)piperidine

2-ethyl-1-(4-methylphenyl)piperidine (PubChem CID 90712958) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-ethyl-1-(4-methylphenyl)piperidine.

Molecular Properties

Compound Name2-ethyl-1-(4-methylphenyl)piperidine
PubChem CID90712958
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-ethyl-1-(4-methylphenyl)piperidine
SMILESCCC1CCCCN1c1ccc(C)cc1
InChIInChI=1S/C14H21N/c1-3-13-6-4-5-11-15(13)14-9-7-12(2)8-10-14/h7-10,13H,3-6,11H2,1-2H3
InChIKeyWLCWTWVBTKASSJ-UHFFFAOYSA-N
XLogP3.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 2-ethyl-1-(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

Related Compounds

2-[1-(4-methylphenyl)piperidin-2-yl]acetic acid
CID 117027896
4-(2-ethylpyrrolidin-1-yl)aniline
CID 60973731
(1S)-1-[4-(2-ethylpiperidin-1-yl)phenyl]propan-1-amine
CID 114066011
4-(2-ethylazepan-1-yl)-2-methylaniline
CID 104688805
N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide
CID 112985422
4-(2-ethylpiperidin-1-yl)-2-methylbenzaldehyde
CID 55038666
[4-(2-ethylazepan-1-yl)-2-methylphenyl]methanamine
CID 104688921
N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113030714
4-(2-ethylazepan-1-yl)-2-methylbenzaldehyde
CID 104690453
(E)-3-[4-(2-ethylazepan-1-yl)phenyl]prop-2-enoic acid
CID 104690853
N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide
CID 112985421
(1S)-1-[4-(2-ethylpyrrolidin-1-yl)phenyl]propan-1-amine
CID 114066064

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(4-methylphenyl)piperidine?
The IUPAC name of 2-ethyl-1-(4-methylphenyl)piperidine (CID 90712958) is 2-ethyl-1-(4-methylphenyl)piperidine.
What is the SMILES notation for 2-ethyl-1-(4-methylphenyl)piperidine?
The canonical SMILES for 2-ethyl-1-(4-methylphenyl)piperidine is CCC1CCCCN1c1ccc(C)cc1.
What is the InChIKey of 2-ethyl-1-(4-methylphenyl)piperidine?
The InChIKey is WLCWTWVBTKASSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-3-13-6-4-5-11-15(13)14-9-7-12(2)8-10-14/h7-10,13H,3-6,11H2,1-2H3.
What are the key properties of 2-ethyl-1-(4-methylphenyl)piperidine?
2-ethyl-1-(4-methylphenyl)piperidine has a molecular weight of 203.33 g/mol, XLogP of 3.76, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(4-methylphenyl)piperidine is sourced from PubChem (CID 90712958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).