(2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine

C16H25NO — CID 106826973

IUPAC(2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine
SMILESCOc1ccc(C)cc1C(N)C1(C)CCCCC1
InChIInChI=1S/C16H25NO/c1-12-7-8-14(18-3)13(11-12)15(17)16(2)9-5-4-6-10-16/h7-8,11,15H,4-6,9-10,17H2,1-3H3
InChIKeyTVEYBFNMEBLPOI-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.97
Rot. Bonds3

About (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine

(2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine (PubChem CID 106826973) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine.

Molecular Properties

Compound Name(2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine
PubChem CID106826973
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name(2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine
SMILESCOc1ccc(C)cc1C(N)C1(C)CCCCC1
InChIInChI=1S/C16H25NO/c1-12-7-8-14(18-3)13(11-12)15(17)16(2)9-5-4-6-10-16/h7-8,11,15H,4-6,9-10,17H2,1-3H3
InChIKeyTVEYBFNMEBLPOI-UHFFFAOYSA-N
XLogP3.97
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine 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

(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanamine
CID 116763532
(2-methoxy-5-methylphenyl)-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79059206
(4,4-dimethylcyclohexyl)-(2-methoxy-5-methylphenyl)methanamine
CID 65391223
[1-(dimethylamino)cycloheptyl]-(2-methoxy-5-methylphenyl)methanol
CID 79063099
(1-methoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanol
CID 116753417
[(1-methoxycyclopentyl)-(2-methoxy-5-methylphenyl)methyl]hydrazine
CID 105268692
(1-methylcyclohexyl)-(2-propan-2-yloxyphenyl)methanamine
CID 106830418
(1-ethoxycyclohexyl)-(2-methoxy-5-methylphenyl)methanol
CID 116753700
(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
CID 106828269
(2S)-2-amino-2-(2-methoxy-5-methylphenyl)ethanol
CID 55278412
1-(2-methoxy-5-methylphenyl)-N-[(1-methylcyclobutyl)methyl]ethanamine
CID 103903195
(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(1-methylcyclopropyl)methanamine
CID 82296040

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine?
The IUPAC name of (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine (CID 106826973) is (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine.
What is the SMILES notation for (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine?
The canonical SMILES for (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine is COc1ccc(C)cc1C(N)C1(C)CCCCC1.
What is the InChIKey of (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine?
The InChIKey is TVEYBFNMEBLPOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-12-7-8-14(18-3)13(11-12)15(17)16(2)9-5-4-6-10-16/h7-8,11,15H,4-6,9-10,17H2,1-3H3.
What are the key properties of (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine?
(2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine has a molecular weight of 247.38 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-5-methylphenyl)-(1-methylcyclohexyl)methanamine is sourced from PubChem (CID 106826973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).