2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol

C15H22FNO2 — CID 102636476

IUPAC2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol
SMILESCOc1ccc(F)cc1CN(C)C1CCCCC1O
InChIInChI=1S/C15H22FNO2/c1-17(13-5-3-4-6-14(13)18)10-11-9-12(16)7-8-15(11)19-2/h7-9,13-14,18H,3-6,10H2,1-2H3
InChIKeyFWAHUDXLZRMEAL-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.57
Rot. Bonds4

About 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol

2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol (PubChem CID 102636476) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol
PubChem CID102636476
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol
SMILESCOc1ccc(F)cc1CN(C)C1CCCCC1O
InChIInChI=1S/C15H22FNO2/c1-17(13-5-3-4-6-14(13)18)10-11-9-12(16)7-8-15(11)19-2/h7-9,13-14,18H,3-6,10H2,1-2H3
InChIKeyFWAHUDXLZRMEAL-UHFFFAOYSA-N
XLogP2.57
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]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

2-[[2-(aminomethyl)-4-fluorophenyl]methyl-methylamino]cyclohexan-1-ol
CID 102631680
2-[(3-fluorophenyl)methyl-methylamino]cyclohexan-1-ol
CID 60714854
N-[(5-fluoro-2-methoxyphenyl)methyl]-N-methylpiperidin-3-amine
CID 63643030
2-[cyclobutyl-[(5-fluoro-2-methoxyphenyl)methyl]amino]ethanol
CID 102676925
N-[(5-bromo-2-methoxyphenyl)methyl]-N,2-dimethylcyclohexan-1-amine
CID 55192223
N-[[2-(aminomethyl)-5-fluorophenyl]methyl]-N,2-dimethylcyclohexan-1-amine
CID 64770644
2-[(2-chloro-3-fluorophenyl)methyl-methylamino]cyclohexan-1-ol
CID 102636615
2-[cyclopropyl-[(5-fluoro-2-methoxyphenyl)methyl]amino]ethanol
CID 60510272
trans-(1S,2S)-2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]cyclohexan-1-ol
CID 102732198
N-[(5-fluoro-2-methoxyphenyl)methyl]-N-methylcarbamoyl chloride
CID 115194745
4-fluoro-2-[[methyl-(2-methylcyclohexyl)amino]methyl]benzenecarbothioamide
CID 64763943
1-cyclopentyl-3-[(5-fluoro-2-methoxyphenyl)methyl]urea
CID 110774857

Frequently Asked Questions

What is the IUPAC name of 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol?
The IUPAC name of 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol (CID 102636476) is 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol?
The canonical SMILES for 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol is COc1ccc(F)cc1CN(C)C1CCCCC1O.
What is the InChIKey of 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol?
The InChIKey is FWAHUDXLZRMEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-17(13-5-3-4-6-14(13)18)10-11-9-12(16)7-8-15(11)19-2/h7-9,13-14,18H,3-6,10H2,1-2H3.
What are the key properties of 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol?
2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol has a molecular weight of 267.34 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-fluoro-2-methoxyphenyl)methyl-methylamino]cyclohexan-1-ol is sourced from PubChem (CID 102636476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).