1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol

C15H22FNO2 — CID 107695107

IUPAC1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol
SMILESCNCc1cc(F)ccc1OCC1(O)CCCCC1
InChIInChI=1S/C15H22FNO2/c1-17-10-12-9-13(16)5-6-14(12)19-11-15(18)7-3-2-4-8-15/h5-6,9,17-18H,2-4,7-8,10-11H2,1H3
InChIKeyHZXMKXCCOYZPHN-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.62
Rot. Bonds5

About 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol

1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol (PubChem CID 107695107) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol
PubChem CID107695107
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol
SMILESCNCc1cc(F)ccc1OCC1(O)CCCCC1
InChIInChI=1S/C15H22FNO2/c1-17-10-12-9-13(16)5-6-14(12)19-11-15(18)7-3-2-4-8-15/h5-6,9,17-18H,2-4,7-8,10-11H2,1H3
InChIKeyHZXMKXCCOYZPHN-UHFFFAOYSA-N
XLogP2.62
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]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

1-[[6-(methylaminomethyl)-1,3-benzodioxol-5-yl]oxymethyl]cyclohexan-1-ol
CID 65208705
1-[[2-fluoro-6-(methylaminomethyl)phenoxy]methyl]cyclopentan-1-ol
CID 112608937
1-[[2-ethoxy-4-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol
CID 65208536
1-[[2-[(1S)-1-aminoethyl]-5-fluorophenoxy]methyl]cyclopentan-1-ol
CID 79004928
1-[[2-[(1R)-1-aminoethyl]-5-fluorophenoxy]methyl]cyclohexan-1-ol
CID 65213345
1-[[5-fluoro-2-[(1R)-1-hydroxyethyl]phenoxy]methyl]cyclohexan-1-ol
CID 65214061
1-[2-(2-chloroprop-2-enoxy)-5-fluorophenyl]-N-methylmethanamine
CID 107695216
1-[[4-methyl-2-[(2-methylpropylamino)methyl]phenoxy]methyl]cyclopentan-1-ol
CID 65211448
1-[[2-[(tert-butylamino)methyl]phenoxy]methyl]cyclohexan-1-ol
CID 65208762
3-[4-fluoro-2-(methylaminomethyl)phenoxy]propane-1,2-diol
CID 107695240
1-[5-fluoro-2-(6-oxaspiro[4.5]decan-9-yloxy)phenyl]-N-methylmethanamine
CID 107695140
1-[[2-(5-fluoro-2-methoxyphenyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 120666403

Frequently Asked Questions

What is the IUPAC name of 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol (CID 107695107) is 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol is CNCc1cc(F)ccc1OCC1(O)CCCCC1.
What is the InChIKey of 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol?
The InChIKey is HZXMKXCCOYZPHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-17-10-12-9-13(16)5-6-14(12)19-11-15(18)7-3-2-4-8-15/h5-6,9,17-18H,2-4,7-8,10-11H2,1H3.
What are the key properties of 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol?
1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol has a molecular weight of 267.34 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-fluoro-2-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol is sourced from PubChem (CID 107695107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).