6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine

C15H24N2O — CID 79239047

IUPAC6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(COC2CC(C)CC(C)C2)n1
InChIInChI=1S/C15H24N2O/c1-11-7-12(2)9-14(8-11)18-10-13-5-4-6-15(16-3)17-13/h4-6,11-12,14H,7-10H2,1-3H3,(H,16,17)
InChIKeyLBCDYDHYGOVRGT-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.46
Rot. Bonds4

About 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine

6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine (PubChem CID 79239047) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine
PubChem CID79239047
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(COC2CC(C)CC(C)C2)n1
InChIInChI=1S/C15H24N2O/c1-11-7-12(2)9-14(8-11)18-10-13-5-4-6-15(16-3)17-13/h4-6,11-12,14H,7-10H2,1-3H3,(H,16,17)
InChIKeyLBCDYDHYGOVRGT-UHFFFAOYSA-N
XLogP3.46
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-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-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine (CID 79239047) is 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine is CNc1cccc(COC2CC(C)CC(C)C2)n1.
What is the InChIKey of 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine?
The InChIKey is LBCDYDHYGOVRGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11-7-12(2)9-14(8-11)18-10-13-5-4-6-15(16-3)17-13/h4-6,11-12,14H,7-10H2,1-3H3,(H,16,17).
What are the key properties of 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine?
6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine has a molecular weight of 248.37 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3,5-dimethylcyclohexyl)oxymethyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 79239047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).