N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine

C17H34N2O — CID 102967402

IUPACN-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
SMILESCCNC1CC(C)CC(C)C1CN1CCCC(OC)C1
InChIInChI=1S/C17H34N2O/c1-5-18-17-10-13(2)9-14(3)16(17)12-19-8-6-7-15(11-19)20-4/h13-18H,5-12H2,1-4H3
InChIKeyJJIIKCMXSCYXFL-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.76
Rot. Bonds5

About N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine

N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine (PubChem CID 102967402) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
PubChem CID102967402
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC NameN-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
SMILESCCNC1CC(C)CC(C)C1CN1CCCC(OC)C1
InChIInChI=1S/C17H34N2O/c1-5-18-17-10-13(2)9-14(3)16(17)12-19-8-6-7-15(11-19)20-4/h13-18H,5-12H2,1-4H3
InChIKeyJJIIKCMXSCYXFL-UHFFFAOYSA-N
XLogP2.76
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-3,5-dimethyl-2-[(3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 64736016
N-ethyl-3,5-dimethyl-2-[(4-propylpiperazin-1-yl)methyl]cyclohexan-1-amine
CID 64736598
2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-N,3,5-trimethylcyclohexan-1-amine
CID 106589038
2-[(3-ethoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64735456
2-[(3-ethoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-ol
CID 64735093
3-[(3-methoxypiperidin-1-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 102963855
N-ethyl-2-(4-methoxypiperidin-1-yl)-3,5-dimethylcyclohexan-1-amine
CID 64722404
2-(azepan-1-ylmethyl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64736211
N-ethyl-2-[2-(3-methoxypiperidin-1-yl)ethyl]cyclopentan-1-amine
CID 102965669
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylmethyl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 115561997
N,3,5-trimethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine
CID 64737195
2-cyclobutyloxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64752392

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine?
The IUPAC name of N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine (CID 102967402) is N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine?
The canonical SMILES for N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine is CCNC1CC(C)CC(C)C1CN1CCCC(OC)C1.
What is the InChIKey of N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine?
The InChIKey is JJIIKCMXSCYXFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-5-18-17-10-13(2)9-14(3)16(17)12-19-8-6-7-15(11-19)20-4/h13-18H,5-12H2,1-4H3.
What are the key properties of N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine?
N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine has a molecular weight of 282.47 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(3-methoxypiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 102967402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).