1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine

C18H30N2O — CID 63156671

IUPAC1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine
SMILESCCC1(C)CCN(C(c2ccccc2OC)C(C)N)CC1
InChIInChI=1S/C18H30N2O/c1-5-18(3)10-12-20(13-11-18)17(14(2)19)15-8-6-7-9-16(15)21-4/h6-9,14,17H,5,10-13,19H2,1-4H3
InChIKeyHCJSFASBQWQNCR-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.60
Rot. Bonds5

About 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine

1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine (PubChem CID 63156671) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine.

Molecular Properties

Compound Name1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine
PubChem CID63156671
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine
SMILESCCC1(C)CCN(C(c2ccccc2OC)C(C)N)CC1
InChIInChI=1S/C18H30N2O/c1-5-18(3)10-12-20(13-11-18)17(14(2)19)15-8-6-7-9-16(15)21-4/h6-9,14,17H,5,10-13,19H2,1-4H3
InChIKeyHCJSFASBQWQNCR-UHFFFAOYSA-N
XLogP3.60
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-fluorophenyl)propan-2-amine
CID 63156273
1-(7,7-dimethyl-1,4-thiazepan-4-yl)-1-(2-methoxyphenyl)propan-2-amine
CID 107453465
1-(2-methoxyphenyl)-1-(4-propan-2-ylpiperidin-1-yl)propan-2-amine
CID 103505314
1-(4-ethyl-4-methylpiperidin-1-yl)-1-pyridin-2-ylpropan-2-amine
CID 55166215
1-[1-[2-amino-1-(2-methoxyphenyl)propyl]pyrrolidin-3-yl]ethanol
CID 115964958
2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine
CID 63160864
1-(2-methoxyphenyl)-1-(3-methylpiperidin-1-yl)propan-2-amine
CID 55022025
2-(4-ethyl-4-methylpiperidin-1-yl)-1-(4-methoxyphenyl)propan-1-one
CID 63158465
1-[2-amino-1-(2-methoxyphenyl)propyl]-4-methylpiperidin-3-ol
CID 102956086
2-(4-ethyl-4-methylpiperidin-1-yl)propan-1-amine
CID 63157136
(1S)-1-[2-(4-ethyl-4-methylpiperidin-1-yl)phenyl]ethanol
CID 78941147
1-(4-butan-2-ylpiperazin-1-yl)-1-(2-fluorophenyl)propan-2-amine
CID 62773806

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine?
The IUPAC name of 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine (CID 63156671) is 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine.
What is the SMILES notation for 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine?
The canonical SMILES for 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine is CCC1(C)CCN(C(c2ccccc2OC)C(C)N)CC1.
What is the InChIKey of 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine?
The InChIKey is HCJSFASBQWQNCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-5-18(3)10-12-20(13-11-18)17(14(2)19)15-8-6-7-9-16(15)21-4/h6-9,14,17H,5,10-13,19H2,1-4H3.
What are the key properties of 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine?
1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine has a molecular weight of 290.45 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine is sourced from PubChem (CID 63156671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).