2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine

C14H21NO — CID 62603851

IUPAC2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine
SMILESCNC1CCCCC1c1cccc(OC)c1
InChIInChI=1S/C14H21NO/c1-15-14-9-4-3-8-13(14)11-6-5-7-12(10-11)16-2/h5-7,10,13-15H,3-4,8-9H2,1-2H3
InChIKeyGTEFVGCIYPUEBM-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.94
Rot. Bonds3

About 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine

2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine (PubChem CID 62603851) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine
PubChem CID62603851
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine
SMILESCNC1CCCCC1c1cccc(OC)c1
InChIInChI=1S/C14H21NO/c1-15-14-9-4-3-8-13(14)11-6-5-7-12(10-11)16-2/h5-7,10,13-15H,3-4,8-9H2,1-2H3
InChIKeyGTEFVGCIYPUEBM-UHFFFAOYSA-N
XLogP2.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(3-methoxyphenyl)cyclohexyl]hydrazine
CID 53402469
N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine
CID 62604232
2-(3-methoxyphenyl)-N-(2-phenylethyl)cyclohexan-1-amine
CID 21260489
2-(2,4-dimethoxyphenyl)-N-methylcycloheptan-1-amine
CID 62802296
1-[2-(3-methoxyphenyl)cycloheptyl]-N-methylmethanamine
CID 81026200
[(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine
CID 69422945
2-(3,4-dimethoxyphenyl)-N-methylcycloheptan-1-amine
CID 62801123
2-(3-methoxyphenyl)cyclopentan-1-amine
CID 62605139
[2-(3-methoxyphenyl)cyclohexyl]methanamine
CID 10443420
4-methoxy-N-[2-(3-methylphenyl)cyclohexyl]aniline
CID 135074214
2-(2,6-dimethoxyphenyl)-N-methylcycloheptan-1-amine
CID 116811017
1-[(1S,2R)-2-(3-methoxyphenyl)cyclohexyl]-N,N-dimethylmethanamine;hydrochloride
CID 22883942

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine?
The IUPAC name of 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine (CID 62603851) is 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine?
The canonical SMILES for 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine is CNC1CCCCC1c1cccc(OC)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine?
The InChIKey is GTEFVGCIYPUEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-15-14-9-4-3-8-13(14)11-6-5-7-12(10-11)16-2/h5-7,10,13-15H,3-4,8-9H2,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine?
2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine is sourced from PubChem (CID 62603851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).