N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine

C16H32N2O — CID 64722404

IUPACN-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine
SMILESCCNC1CC(C)CC(C)C1N1CCC(OC)CC1
InChIInChI=1S/C16H32N2O/c1-5-17-15-11-12(2)10-13(3)16(15)18-8-6-14(19-4)7-9-18/h12-17H,5-11H2,1-4H3
InChIKeyAFXKOFLWWRIAIF-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.51
Rot. Bonds4

About N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine

N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine (PubChem CID 64722404) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine
PubChem CID64722404
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine
SMILESCCNC1CC(C)CC(C)C1N1CCC(OC)CC1
InChIInChI=1S/C16H32N2O/c1-5-17-15-11-12(2)10-13(3)16(15)18-8-6-14(19-4)7-9-18/h12-17H,5-11H2,1-4H3
InChIKeyAFXKOFLWWRIAIF-UHFFFAOYSA-N
XLogP2.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxypiperidin-1-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64725027
N-ethyl-3,5-dimethyl-2-(4-propan-2-ylazepan-1-yl)cyclohexan-1-amine
CID 64750791
2-(3,4-dimethylpiperazin-1-yl)-N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64751767
N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 102967402
2-[4-(methoxymethyl)piperidin-1-yl]-N,3,5-trimethylcyclohexan-1-amine
CID 64752559
2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64752392
N,4-diethyl-2-(3-methoxypyrrolidin-1-yl)cyclohexan-1-amine
CID 103532122
2-ethoxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64751781
2-(3-ethylpiperidin-1-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64723017
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 115559618
N-ethyl-3,5-dimethyl-2-[(4-propylpiperazin-1-yl)methyl]cyclohexan-1-amine
CID 64736598
N-ethyl-2-imidazol-1-yl-3,5-dimethylcyclohexan-1-amine
CID 64752363

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine?
The IUPAC name of N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine (CID 64722404) is N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine?
The canonical SMILES for N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine is CCNC1CC(C)CC(C)C1N1CCC(OC)CC1.
What is the InChIKey of N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine?
The InChIKey is AFXKOFLWWRIAIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-5-17-15-11-12(2)10-13(3)16(15)18-8-6-14(19-4)7-9-18/h12-17H,5-11H2,1-4H3.
What are the key properties of N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine?
N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine has a molecular weight of 268.44 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 64722404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).