2-(4-ethylphenyl)-N-methylpiperidin-4-amine

C14H22N2 — CID 117000329

IUPAC2-(4-ethylphenyl)-N-methylpiperidin-4-amine
SMILESCCc1ccc(C2CC(NC)CCN2)cc1
InChIInChI=1S/C14H22N2/c1-3-11-4-6-12(7-5-11)14-10-13(15-2)8-9-16-14/h4-7,13-16H,3,8-10H2,1-2H3
InChIKeyFJVORQCEPBWVIN-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.26
Rot. Bonds3

About 2-(4-ethylphenyl)-N-methylpiperidin-4-amine

2-(4-ethylphenyl)-N-methylpiperidin-4-amine (PubChem CID 117000329) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name2-(4-ethylphenyl)-N-methylpiperidin-4-amine
PubChem CID117000329
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2-(4-ethylphenyl)-N-methylpiperidin-4-amine
SMILESCCc1ccc(C2CC(NC)CCN2)cc1
InChIInChI=1S/C14H22N2/c1-3-11-4-6-12(7-5-11)14-10-13(15-2)8-9-16-14/h4-7,13-16H,3,8-10H2,1-2H3
InChIKeyFJVORQCEPBWVIN-UHFFFAOYSA-N
XLogP2.26
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethylphenyl)-N,N-dimethylpiperidin-4-amine
CID 117000299
ethane;(2S,4R)-N-ethyl-2-(4-fluorophenyl)piperidin-4-amine;molecular hydrogen
CID 165141938
2-(4-ethylphenyl)piperazine
CID 45036830
4-(difluoromethyl)-2-(4-ethylphenyl)pyrrolidine
CID 176842061
2-(2,4-dimethylphenyl)-N-methylpiperidin-4-amine
CID 117000343
N-(4-ethylphenyl)piperidin-4-amine
CID 43829435
2-(4-butylphenyl)azetidine
CID 55273387
methyl 4-[(2R,4R)-4-ethylpiperidin-2-yl]benzoate
CID 125468766
[6-(4-ethylphenyl)piperidin-3-yl]methanol
CID 117000409
(2S)-4-ethyl-2-phenylpiperidine
CID 170718389
4-(2-ethyl-1H-pyrrol-3-yl)-2-phenylpiperidine
CID 70283329
1-(4-ethylphenyl)-N,2-dimethylpiperidin-4-amine
CID 54975874

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-N-methylpiperidin-4-amine?
The IUPAC name of 2-(4-ethylphenyl)-N-methylpiperidin-4-amine (CID 117000329) is 2-(4-ethylphenyl)-N-methylpiperidin-4-amine.
What is the SMILES notation for 2-(4-ethylphenyl)-N-methylpiperidin-4-amine?
The canonical SMILES for 2-(4-ethylphenyl)-N-methylpiperidin-4-amine is CCc1ccc(C2CC(NC)CCN2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-N-methylpiperidin-4-amine?
The InChIKey is FJVORQCEPBWVIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-3-11-4-6-12(7-5-11)14-10-13(15-2)8-9-16-14/h4-7,13-16H,3,8-10H2,1-2H3.
What are the key properties of 2-(4-ethylphenyl)-N-methylpiperidin-4-amine?
2-(4-ethylphenyl)-N-methylpiperidin-4-amine has a molecular weight of 218.34 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-N-methylpiperidin-4-amine is sourced from PubChem (CID 117000329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).