1-(3-ethylphenyl)-N-methylpiperidin-4-amine

C14H22N2 — CID 43315435

IUPAC1-(3-ethylphenyl)-N-methylpiperidin-4-amine
SMILESCCc1cccc(N2CCC(NC)CC2)c1
InChIInChI=1S/C14H22N2/c1-3-12-5-4-6-14(11-12)16-9-7-13(15-2)8-10-16/h4-6,11,13,15H,3,7-10H2,1-2H3
InChIKeyQPUCOOHEZPGCTE-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.44
Rot. Bonds3

About 1-(3-ethylphenyl)-N-methylpiperidin-4-amine

1-(3-ethylphenyl)-N-methylpiperidin-4-amine (PubChem CID 43315435) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-(3-ethylphenyl)-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-(3-ethylphenyl)-N-methylpiperidin-4-amine
PubChem CID43315435
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name1-(3-ethylphenyl)-N-methylpiperidin-4-amine
SMILESCCc1cccc(N2CCC(NC)CC2)c1
InChIInChI=1S/C14H22N2/c1-3-12-5-4-6-14(11-12)16-9-7-13(15-2)8-10-16/h4-6,11,13,15H,3,7-10H2,1-2H3
InChIKeyQPUCOOHEZPGCTE-UHFFFAOYSA-N
XLogP2.44
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(methoxymethyl)phenyl]-N-methylpiperidin-4-amine
CID 54965277
1-cyclopropyl-3-[1-(3-ethylphenyl)piperidin-4-yl]thiourea
CID 48926076
1-(3-ethylphenyl)piperazine;hydrochloride
CID 19911472
4-(3-ethylphenyl)-1-hydroxy-1-methylpiperazin-1-ium
CID 145226331
1-[4-(3-ethylphenyl)piperazin-1-yl]ethanethione
CID 143169930
N-[1-[3-(aminomethyl)phenyl]piperidin-4-yl]acetamide
CID 102814279
N-[1-(3-ethylphenyl)piperidin-4-yl]-2,2,6-trimethylmorpholine-4-carboxamide
CID 49132886
(2R,6R)-4-(3-ethylphenyl)-2,6-dimethylmorpholine
CID 165121156
1-(3-bromo-4-methylphenyl)-N-methylpiperidin-4-amine
CID 63334285
(2S)-4-(3-ethylphenyl)-2,6-dimethylmorpholine
CID 59545911
[3-(4-propan-2-ylazepan-1-yl)phenyl]methanamine
CID 102814059
N-(3-ethylphenyl)-2-[4-(methylamino)piperidin-1-yl]acetamide
CID 119923733

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylphenyl)-N-methylpiperidin-4-amine?
The IUPAC name of 1-(3-ethylphenyl)-N-methylpiperidin-4-amine (CID 43315435) is 1-(3-ethylphenyl)-N-methylpiperidin-4-amine.
What is the SMILES notation for 1-(3-ethylphenyl)-N-methylpiperidin-4-amine?
The canonical SMILES for 1-(3-ethylphenyl)-N-methylpiperidin-4-amine is CCc1cccc(N2CCC(NC)CC2)c1.
What is the InChIKey of 1-(3-ethylphenyl)-N-methylpiperidin-4-amine?
The InChIKey is QPUCOOHEZPGCTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-3-12-5-4-6-14(11-12)16-9-7-13(15-2)8-10-16/h4-6,11,13,15H,3,7-10H2,1-2H3.
What are the key properties of 1-(3-ethylphenyl)-N-methylpiperidin-4-amine?
1-(3-ethylphenyl)-N-methylpiperidin-4-amine has a molecular weight of 218.34 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylphenyl)-N-methylpiperidin-4-amine is sourced from PubChem (CID 43315435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).