2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol

C15H23NO2 — CID 21317833

IUPAC2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol
SMILESCNC(c1cccc(OC)c1)C1CCCCC1O
InChIInChI=1S/C15H23NO2/c1-16-15(13-8-3-4-9-14(13)17)11-6-5-7-12(10-11)18-2/h5-7,10,13-17H,3-4,8-9H2,1-2H3
InChIKeyJIWACDKWQYUXLW-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.51
Rot. Bonds4

About 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol

2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol (PubChem CID 21317833) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol
PubChem CID21317833
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol
SMILESCNC(c1cccc(OC)c1)C1CCCCC1O
InChIInChI=1S/C15H23NO2/c1-16-15(13-8-3-4-9-14(13)17)11-6-5-7-12(10-11)18-2/h5-7,10,13-17H,3-4,8-9H2,1-2H3
InChIKeyJIWACDKWQYUXLW-UHFFFAOYSA-N
XLogP2.51
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol 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

cis-(1R,2R)-2-[dimethylamino-(3-methoxyphenyl)methyl]cyclohexan-1-ol;hydrochloride
CID 70600998
1-(3-methoxyphenyl)-N-methyl-1-(thian-2-yl)methanamine
CID 80626476
(1S)-2-[(1R)-2-amino-1-(3-methoxyphenyl)ethyl]cyclohexan-1-ol
CID 70378403
[cyclohexyl-(3-methoxyphenyl)methyl]hydrazine
CID 105191678
N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine
CID 60797775
N-methyl-1-(2-methylcyclopentyl)-1-(3-propan-2-yloxyphenyl)methanamine
CID 107190280
1-(3-methoxyphenyl)-N-methyl-1-(3-methyl-1,4-dithian-2-yl)methanamine
CID 113299540
2-cyclopentyl-2-(3-methoxyphenyl)-N-methylethanamine
CID 79019406
(3-methoxyphenyl)-[(2S)-piperidin-2-yl]methanol
CID 69187424
2-[[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]amino]cyclohexan-1-ol
CID 60714933
2-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]-2-(3-methoxyphenyl)-N-methylacetamide
CID 13055743
N-cyclopentyloxy-1-(3-methoxyphenyl)ethanamine
CID 83229346

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol?
The IUPAC name of 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol (CID 21317833) is 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol is CNC(c1cccc(OC)c1)C1CCCCC1O.
What is the InChIKey of 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol?
The InChIKey is JIWACDKWQYUXLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-16-15(13-8-3-4-9-14(13)17)11-6-5-7-12(10-11)18-2/h5-7,10,13-17H,3-4,8-9H2,1-2H3.
What are the key properties of 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol?
2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol has a molecular weight of 249.35 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenyl)-(methylamino)methyl]cyclohexan-1-ol is sourced from PubChem (CID 21317833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).