1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine

C17H28N2O2 — CID 61420654

IUPAC1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine
SMILESCCC1CCN(CC(N)c2ccc(OC)cc2OC)CC1
InChIInChI=1S/C17H28N2O2/c1-4-13-7-9-19(10-8-13)12-16(18)15-6-5-14(20-2)11-17(15)21-3/h5-6,11,13,16H,4,7-10,12,18H2,1-3H3
InChIKeyWRBKVTNWJPIODA-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.83
Rot. Bonds6

About 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine

1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine (PubChem CID 61420654) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine
PubChem CID61420654
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine
SMILESCCC1CCN(CC(N)c2ccc(OC)cc2OC)CC1
InChIInChI=1S/C17H28N2O2/c1-4-13-7-9-19(10-8-13)12-16(18)15-6-5-14(20-2)11-17(15)21-3/h5-6,11,13,16H,4,7-10,12,18H2,1-3H3
InChIKeyWRBKVTNWJPIODA-UHFFFAOYSA-N
XLogP2.83
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,4-dimethoxyphenyl)-2-(2-methylmorpholin-4-yl)ethanamine
CID 16786884
[(2,4-dimethoxyphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105231570
1-(2-methoxyphenyl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine
CID 103495074
1-(2,5-dimethoxyphenyl)-2-morpholin-4-ylethanamine
CID 16780959
(2,4-dimethoxyphenyl)-(3-ethylcyclohexyl)methanamine
CID 65414537
1-(2,5-dimethoxyphenyl)-2-(3-methoxypyrrolidin-1-yl)ethanamine
CID 103532358
1-[2-amino-2-(2,4-dimethoxyphenyl)ethyl]pyridin-4-one
CID 62881699
2-(2,4-dimethoxyphenyl)-2-(1-ethylpiperidin-4-yl)ethanamine
CID 83973119
1-[2-amino-2-(2,5-dimethoxyphenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63163900
1-(2,5-dimethoxyphenyl)-2-(3-ethylpyrrolidin-1-yl)ethanol
CID 115688534
1-[2-amino-2-(2,4-dimethoxyphenyl)ethyl]piperidin-2-one
CID 43212302
2-chloro-1-(2,4-dimethoxyphenyl)ethanamine
CID 116937529

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine?
The IUPAC name of 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine (CID 61420654) is 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine?
The canonical SMILES for 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine is CCC1CCN(CC(N)c2ccc(OC)cc2OC)CC1.
What is the InChIKey of 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine?
The InChIKey is WRBKVTNWJPIODA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-4-13-7-9-19(10-8-13)12-16(18)15-6-5-14(20-2)11-17(15)21-3/h5-6,11,13,16H,4,7-10,12,18H2,1-3H3.
What are the key properties of 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine?
1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine has a molecular weight of 292.42 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 61420654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).