1,2-dicyclohexyl-2-methoxy-N-methylethanamine

C16H31NO — CID 116771418

IUPAC1,2-dicyclohexyl-2-methoxy-N-methylethanamine
SMILESCNC(C1CCCCC1)C(OC)C1CCCCC1
InChIInChI=1S/C16H31NO/c1-17-15(13-9-5-3-6-10-13)16(18-2)14-11-7-4-8-12-14/h13-17H,3-12H2,1-2H3
InChIKeyOWJKLSKJGXKHAI-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.75
Rot. Bonds5

About 1,2-dicyclohexyl-2-methoxy-N-methylethanamine

1,2-dicyclohexyl-2-methoxy-N-methylethanamine (PubChem CID 116771418) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 1,2-dicyclohexyl-2-methoxy-N-methylethanamine.

Molecular Properties

Compound Name1,2-dicyclohexyl-2-methoxy-N-methylethanamine
PubChem CID116771418
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name1,2-dicyclohexyl-2-methoxy-N-methylethanamine
SMILESCNC(C1CCCCC1)C(OC)C1CCCCC1
InChIInChI=1S/C16H31NO/c1-17-15(13-9-5-3-6-10-13)16(18-2)14-11-7-4-8-12-14/h13-17H,3-12H2,1-2H3
InChIKeyOWJKLSKJGXKHAI-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1,2-dicyclohexyl-2-methoxy-N-methylethanamine 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

1,2-dicyclohexyl-N-ethyl-2-methoxyethanamine
CID 116771642
1-cyclopentyl-2-methoxy-N-methylpropan-1-amine
CID 79616561
1-cyclohexyl-2,2-difluoro-N-methylethanamine
CID 80606050
N-(2-cyclohexyl-1-cyclopropyl-2-methoxyethyl)propan-1-amine
CID 116771906
1-cycloheptyl-2-methoxy-N-methylpentan-1-amine
CID 116718958
1-cyclohexyl-1-(methylamino)propan-2-ol
CID 116859518
1-cyclohexyl-1-N-methylpropane-1,2-diamine
CID 116948168
N-[2-cyclohexyl-2-methoxy-1-(oxan-4-yl)ethyl]propan-1-amine
CID 116771903
2-cyclohexyl-1-(3,4-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771600
[2-cyclohexyl-2-methoxy-1-(oxolan-3-yl)ethyl]hydrazine
CID 105278591
2-cyclohexyl-1-(2,3-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771448
1-cyclohexyl-3,3,3-trifluoro-N-methyl-2-(trifluoromethyl)propan-1-amine
CID 103311643

Frequently Asked Questions

What is the IUPAC name of 1,2-dicyclohexyl-2-methoxy-N-methylethanamine?
The IUPAC name of 1,2-dicyclohexyl-2-methoxy-N-methylethanamine (CID 116771418) is 1,2-dicyclohexyl-2-methoxy-N-methylethanamine.
What is the SMILES notation for 1,2-dicyclohexyl-2-methoxy-N-methylethanamine?
The canonical SMILES for 1,2-dicyclohexyl-2-methoxy-N-methylethanamine is CNC(C1CCCCC1)C(OC)C1CCCCC1.
What is the InChIKey of 1,2-dicyclohexyl-2-methoxy-N-methylethanamine?
The InChIKey is OWJKLSKJGXKHAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-17-15(13-9-5-3-6-10-13)16(18-2)14-11-7-4-8-12-14/h13-17H,3-12H2,1-2H3.
What are the key properties of 1,2-dicyclohexyl-2-methoxy-N-methylethanamine?
1,2-dicyclohexyl-2-methoxy-N-methylethanamine has a molecular weight of 253.43 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dicyclohexyl-2-methoxy-N-methylethanamine is sourced from PubChem (CID 116771418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).