[(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine

C16H28N2O — CID 69422945

IUPAC[(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine
SMILESCNC.COc1cccc([C@@H]2CCCC[C@H]2CN)c1
InChIInChI=1S/C14H21NO.C2H7N/c1-16-13-7-4-6-11(9-13)14-8-3-2-5-12(14)10-15;1-3-2/h4,6-7,9,12,14H,2-3,5,8,10,15H2,1H3;3H,1-2H3/t12-,14-;/m0./s1
InChIKeyGXSUPXHFASOJQS-KYSPHBLOSA-N
MW264.41 g/mol
LogP2.76
Rot. Bonds3

About [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine

[(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine (PubChem CID 69422945) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine.

Molecular Properties

Compound Name[(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine
PubChem CID69422945
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name[(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine
SMILESCNC.COc1cccc([C@@H]2CCCC[C@H]2CN)c1
InChIInChI=1S/C14H21NO.C2H7N/c1-16-13-7-4-6-11(9-13)14-8-3-2-5-12(14)10-15;1-3-2/h4,6-7,9,12,14H,2-3,5,8,10,15H2,1H3;3H,1-2H3/t12-,14-;/m0./s1
InChIKeyGXSUPXHFASOJQS-KYSPHBLOSA-N
XLogP2.76
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine 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

[2-(3-methoxyphenyl)cyclohexyl]methanamine
CID 10443420
1-[2-(3-methoxyphenyl)cycloheptyl]-N-methylmethanamine
CID 81026200
[2-(3-cyclopropyloxyphenyl)cycloheptyl]methanamine
CID 114523516
1-[(1S,2R)-2-(3-methoxyphenyl)cyclohexyl]-N,N-dimethylmethanamine;hydrochloride
CID 22883942
[4-tert-butyl-2-(3-methoxyphenyl)cyclohexyl]methanamine
CID 81012051
[2-[3-(trifluoromethoxy)phenyl]cycloheptyl]methanamine
CID 81010948
2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine
CID 62603851
2-(3-methoxyphenyl)cyclopentan-1-amine
CID 62605139
[2-(3-methoxyphenyl)cyclohexyl]hydrazine
CID 53402469
1-[2-(3-methoxyphenyl)cyclopropyl]-N-methylmethanamine
CID 53275643
1-[(1R,2S)-2-(3-methoxyphenyl)cyclopropyl]-N-methylmethanamine
CID 94558345
2-[(1S,2R)-2-(3-methoxyphenyl)cyclopropyl]ethanamine
CID 139707086

Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine?
The IUPAC name of [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine (CID 69422945) is [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine.
What is the SMILES notation for [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine?
The canonical SMILES for [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine is CNC.COc1cccc([C@@H]2CCCC[C@H]2CN)c1.
What is the InChIKey of [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine?
The InChIKey is GXSUPXHFASOJQS-KYSPHBLOSA-N. The full InChI is InChI=1S/C14H21NO.C2H7N/c1-16-13-7-4-6-11(9-13)14-8-3-2-5-12(14)10-15;1-3-2/h4,6-7,9,12,14H,2-3,5,8,10,15H2,1H3;3H,1-2H3/t12-,14-;/m0./s1.
What are the key properties of [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine?
[(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine has a molecular weight of 264.41 g/mol, XLogP of 2.76, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine is sourced from PubChem (CID 69422945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).