2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine

C19H32N2 — CID 63469851

IUPAC2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine
SMILESCCc1ccc(C(NC)C(C)N2CCC(C)CC2C)cc1
InChIInChI=1S/C19H32N2/c1-6-17-7-9-18(10-8-17)19(20-5)16(4)21-12-11-14(2)13-15(21)3/h7-10,14-16,19-20H,6,11-13H2,1-5H3
InChIKeyAZFZVVKFRXZIKD-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.02
Rot. Bonds5

About 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine

2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine (PubChem CID 63469851) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine
PubChem CID63469851
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine
SMILESCCc1ccc(C(NC)C(C)N2CCC(C)CC2C)cc1
InChIInChI=1S/C19H32N2/c1-6-17-7-9-18(10-8-17)19(20-5)16(4)21-12-11-14(2)13-15(21)3/h7-10,14-16,19-20H,6,11-13H2,1-5H3
InChIKeyAZFZVVKFRXZIKD-UHFFFAOYSA-N
XLogP4.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethylphenyl)-N-methyl-2-(4-methylazepan-1-yl)propan-1-amine
CID 63624077
2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine
CID 63469493
1-(4-ethylphenyl)-2-(3-methoxypiperidin-1-yl)-N-methylpropan-1-amine
CID 102965616
1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine
CID 116948027
1-(4-ethylphenyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 63414820
2-(3,4-dichlorophenyl)-2-(2,4-dimethylpiperidin-1-yl)ethanamine
CID 62330318
2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine
CID 63468460
(2R,4R)-2,4-dimethyl-1-propan-2-ylpiperidine
CID 176766721
1-(4-chlorophenyl)-1-(2,4-dimethylpiperidin-1-yl)propan-2-amine
CID 62330116
1-(2,4-dimethylpiperidin-1-yl)-1-(4-fluorophenyl)butan-2-amine
CID 62329945
N-methyl-1-(4-methylphenyl)-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 103495133
1-(4-ethylphenyl)-N-methyl-2-(3-methylcyclohexyl)sulfanylethanamine
CID 64632423

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine?
The IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine (CID 63469851) is 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine.
What is the SMILES notation for 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine?
The canonical SMILES for 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine is CCc1ccc(C(NC)C(C)N2CCC(C)CC2C)cc1.
What is the InChIKey of 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine?
The InChIKey is AZFZVVKFRXZIKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-6-17-7-9-18(10-8-17)19(20-5)16(4)21-12-11-14(2)13-15(21)3/h7-10,14-16,19-20H,6,11-13H2,1-5H3.
What are the key properties of 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine?
2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine has a molecular weight of 288.48 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylpiperidin-1-yl)-1-(4-ethylphenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 63469851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).