[2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine

C19H25NO — CID 64735117

IUPAC[2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine
SMILESCC1CC(C)CC(Oc2ccc3ccccc3c2CN)C1
InChIInChI=1S/C19H25NO/c1-13-9-14(2)11-16(10-13)21-19-8-7-15-5-3-4-6-17(15)18(19)12-20/h3-8,13-14,16H,9-12,20H2,1-2H3
InChIKeyMGFIBMQVBVGWNF-UHFFFAOYSA-N
MW283.41 g/mol
LogP4.50
Rot. Bonds3

About [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine

[2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine (PubChem CID 64735117) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine.

Molecular Properties

Compound Name[2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine
PubChem CID64735117
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC Name[2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine
SMILESCC1CC(C)CC(Oc2ccc3ccccc3c2CN)C1
InChIInChI=1S/C19H25NO/c1-13-9-14(2)11-16(10-13)21-19-8-7-15-5-3-4-6-17(15)18(19)12-20/h3-8,13-14,16H,9-12,20H2,1-2H3
InChIKeyMGFIBMQVBVGWNF-UHFFFAOYSA-N
XLogP4.50
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine 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 [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine?
The IUPAC name of [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine (CID 64735117) is [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine.
What is the SMILES notation for [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine?
The canonical SMILES for [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine is CC1CC(C)CC(Oc2ccc3ccccc3c2CN)C1.
What is the InChIKey of [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine?
The InChIKey is MGFIBMQVBVGWNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13-9-14(2)11-16(10-13)21-19-8-7-15-5-3-4-6-17(15)18(19)12-20/h3-8,13-14,16H,9-12,20H2,1-2H3.
What are the key properties of [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine?
[2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine has a molecular weight of 283.41 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,5-dimethylcyclohexyl)oxynaphthalen-1-yl]methanamine is sourced from PubChem (CID 64735117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).