2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol

C16H25NO2 — CID 55013429

IUPAC2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol
SMILESCOc1ccc(CNCC2CCCCC2C)cc1O
InChIInChI=1S/C16H25NO2/c1-12-5-3-4-6-14(12)11-17-10-13-7-8-16(19-2)15(18)9-13/h7-9,12,14,17-18H,3-6,10-11H2,1-2H3
InChIKeyUBEMUSLEXGXYEU-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.32
Rot. Bonds5

About 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol

2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol (PubChem CID 55013429) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol.

Molecular Properties

Compound Name2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol
PubChem CID55013429
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol
SMILESCOc1ccc(CNCC2CCCCC2C)cc1O
InChIInChI=1S/C16H25NO2/c1-12-5-3-4-6-14(12)11-17-10-13-7-8-16(19-2)15(18)9-13/h7-9,12,14,17-18H,3-6,10-11H2,1-2H3
InChIKeyUBEMUSLEXGXYEU-UHFFFAOYSA-N
XLogP3.32
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol 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

5-[(2-bicyclo[2.2.1]heptanylmethylamino)methyl]-2-methoxyphenol
CID 62734294
2-methoxy-4-[[(2-methylcyclohexyl)methylamino]methyl]benzonitrile
CID 106787316
N-[(3,4-dimethylphenyl)methyl]-1-(2-methylcyclohexyl)methanamine
CID 55194085
1-cyclopentyl-N-[(3,4-dimethoxyphenyl)methyl]methanamine
CID 43317290
2-bromo-4-[[(2-methylcyclopentyl)methylamino]methyl]phenol
CID 107416951
2-methoxy-4-[[(2-methylcyclopropyl)methylamino]methyl]phenol
CID 115978487
2-[[(3-bromo-4-methoxyphenyl)methylamino]methyl]cyclohexan-1-ol
CID 64929394
2-methoxy-5-[[(1-methylpyrrolidin-3-yl)methylamino]methyl]phenol
CID 54927262
5-[[2-[cyclopentyl(methyl)amino]ethylamino]methyl]-2-methoxyphenol
CID 63315050
1-(2-methylcyclohexyl)-N-[(4-methylphenyl)methyl]methanamine
CID 63455202
N-[(3,5-dimethylphenyl)methyl]-1-(2-methylcyclohexyl)methanamine
CID 63456073
2,6-difluoro-4-[[(2-methylcyclohexyl)methylamino]methyl]phenol
CID 79831663

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol?
The IUPAC name of 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol (CID 55013429) is 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol.
What is the SMILES notation for 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol?
The canonical SMILES for 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol is COc1ccc(CNCC2CCCCC2C)cc1O.
What is the InChIKey of 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol?
The InChIKey is UBEMUSLEXGXYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-12-5-3-4-6-14(12)11-17-10-13-7-8-16(19-2)15(18)9-13/h7-9,12,14,17-18H,3-6,10-11H2,1-2H3.
What are the key properties of 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol?
2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol has a molecular weight of 263.38 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[[(2-methylcyclohexyl)methylamino]methyl]phenol is sourced from PubChem (CID 55013429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).