N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine

C15H30N2O — CID 55090187

IUPACN-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine
SMILESCOC1CCN(CCNC2CCCC(C)C2)CC1
InChIInChI=1S/C15H30N2O/c1-13-4-3-5-14(12-13)16-8-11-17-9-6-15(18-2)7-10-17/h13-16H,3-12H2,1-2H3
InChIKeyNDOVBSJPKCTIHJ-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds5

About N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine

N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine (PubChem CID 55090187) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine
PubChem CID55090187
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine
SMILESCOC1CCN(CCNC2CCCC(C)C2)CC1
InChIInChI=1S/C15H30N2O/c1-13-4-3-5-14(12-13)16-8-11-17-9-6-15(18-2)7-10-17/h13-16H,3-12H2,1-2H3
InChIKeyNDOVBSJPKCTIHJ-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-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

4-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 784225
3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 2846685
3-[1-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-yl]oxypropan-1-amine
CID 79736167
[4-Methoxy-1-[4-(trifluoromethyl)cyclohexyl]piperidin-2-yl]methanamine
CID 115963173
[4-Methoxy-1-[3-(trifluoromethyl)cyclohexyl]piperidin-2-yl]methanamine
CID 115963209
[1-[(3,3-Difluorocyclohexyl)methyl]-4-methoxypiperidin-2-yl]methanamine;hydrochloride
CID 121669957
[1-[(3,3-Difluorocyclohexyl)methyl]-4-methoxypiperidin-2-yl]methanamine
CID 121669958
1-(2-Cyclohexylpiperazin-1-yl)ethanol
CID 21242424
[2-(Aminomethyl)-1-(3-methoxy-2-methylpropyl)piperidin-4-yl]methanamine
CID 57578611
(S)-1-(4-Methoxypiperidin-1-yl)-N,3-dimethylbutan-2-amine
CID 67773742
1-(4-methoxypiperidin-1-yl)-N,3-dimethylbutan-2-amine
CID 67773747
(2S)-1-(4-methoxypiperidin-1-yl)-3-methylbutan-2-amine
CID 93289890

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine?
The IUPAC name of N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine (CID 55090187) is N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine.
What is the SMILES notation for N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine?
The canonical SMILES for N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine is COC1CCN(CCNC2CCCC(C)C2)CC1.
What is the InChIKey of N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine?
The InChIKey is NDOVBSJPKCTIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-13-4-3-5-14(12-13)16-8-11-17-9-6-15(18-2)7-10-17/h13-16H,3-12H2,1-2H3.
What are the key properties of N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine?
N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxypiperidin-1-yl)ethyl]-3-methylcyclohexan-1-amine is sourced from PubChem (CID 55090187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).