6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine

C16H31NO — CID 79834960

IUPAC6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine
SMILESCNC1C(OCC2CCCCC2)CCCC1(C)C
InChIInChI=1S/C16H31NO/c1-16(2)11-7-10-14(15(16)17-3)18-12-13-8-5-4-6-9-13/h13-15,17H,4-12H2,1-3H3
InChIKeyRYWPPLMYIBKQCV-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.75
Rot. Bonds4

About 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine

6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine (PubChem CID 79834960) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine
PubChem CID79834960
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine
SMILESCNC1C(OCC2CCCCC2)CCCC1(C)C
InChIInChI=1S/C16H31NO/c1-16(2)11-7-10-14(15(16)17-3)18-12-13-8-5-4-6-9-13/h13-15,17H,4-12H2,1-3H3
InChIKeyRYWPPLMYIBKQCV-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-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

Frequently Asked Questions

What is the IUPAC name of 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine?
The IUPAC name of 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine (CID 79834960) is 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine.
What is the SMILES notation for 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine?
The canonical SMILES for 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine is CNC1C(OCC2CCCCC2)CCCC1(C)C.
What is the InChIKey of 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine?
The InChIKey is RYWPPLMYIBKQCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-16(2)11-7-10-14(15(16)17-3)18-12-13-8-5-4-6-9-13/h13-15,17H,4-12H2,1-3H3.
What are the key properties of 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine?
6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclohexylmethoxy)-N,2,2-trimethylcyclohexan-1-amine is sourced from PubChem (CID 79834960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).