2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine

C19H32N2 — CID 63469493

IUPAC2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine
SMILESCCNC(CN1CCC(C)CC1C)c1ccc(CC)cc1
InChIInChI=1S/C19H32N2/c1-5-17-7-9-18(10-8-17)19(20-6-2)14-21-12-11-15(3)13-16(21)4/h7-10,15-16,19-20H,5-6,11-14H2,1-4H3
InChIKeyOXVMNDKSJLYIEP-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.02
Rot. Bonds6

About 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine

2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine (PubChem CID 63469493) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine
PubChem CID63469493
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine
SMILESCCNC(CN1CCC(C)CC1C)c1ccc(CC)cc1
InChIInChI=1S/C19H32N2/c1-5-17-7-9-18(10-8-17)19(20-6-2)14-21-12-11-15(3)13-16(21)4/h7-10,15-16,19-20H,5-6,11-14H2,1-4H3
InChIKeyOXVMNDKSJLYIEP-UHFFFAOYSA-N
XLogP4.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
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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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine?
The IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine (CID 63469493) is 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine.
What is the SMILES notation for 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine?
The canonical SMILES for 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine is CCNC(CN1CCC(C)CC1C)c1ccc(CC)cc1.
What is the InChIKey of 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine?
The InChIKey is OXVMNDKSJLYIEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-17-7-9-18(10-8-17)19(20-6-2)14-21-12-11-15(3)13-16(21)4/h7-10,15-16,19-20H,5-6,11-14H2,1-4H3.
What are the key properties of 2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine?
2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-1-(4-ethylphenyl)ethanamine has a molecular weight of 288.48 g/mol, XLogP of 4.02, 6 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)-N-ethyl-1-(4-ethylphenyl)ethanamine is sourced from PubChem (CID 63469493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).