1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol

C14H20O3 — CID 65213494

IUPAC1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol
SMILESCOc1cccc(OCC2(O)CCCCC2)c1
InChIInChI=1S/C14H20O3/c1-16-12-6-5-7-13(10-12)17-11-14(15)8-3-2-4-9-14/h5-7,10,15H,2-4,8-9,11H2,1H3
InChIKeyRBILQMXAQXGLDL-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.77
Rot. Bonds4

About 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol

1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol (PubChem CID 65213494) has the molecular formula C14H20O3 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol
PubChem CID65213494
Molecular FormulaC14H20O3
Molecular Weight236.31 g/mol
Exact Mass236.14
IUPAC Name1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol
SMILESCOc1cccc(OCC2(O)CCCCC2)c1
InChIInChI=1S/C14H20O3/c1-16-12-6-5-7-13(10-12)17-11-14(15)8-3-2-4-9-14/h5-7,10,15H,2-4,8-9,11H2,1H3
InChIKeyRBILQMXAQXGLDL-UHFFFAOYSA-N
XLogP2.77
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3-propoxyphenoxy)methyl]cyclohexan-1-ol
CID 69097328
4-[(3-methoxyphenoxy)methyl]piperidin-4-ol
CID 81042080
1-(bromomethyl)-1-[(3-methoxyphenoxy)methyl]cycloheptane
CID 65009956
1-[(3-propoxyphenoxy)methyl]cyclopentan-1-ol
CID 69097510
1-[(3-fluorophenoxy)methyl]cyclohexan-1-ol
CID 65213847
1-[[3-(1-aminoethyl)phenoxy]methyl]cyclohexan-1-ol
CID 65208420
4-hydroxy-4-[(3-methoxyphenoxy)methyl]cyclohexane-1-carboxylic acid
CID 106497082
1-[[3-(methylaminomethyl)phenoxy]methyl]cyclohexan-1-ol
CID 65208592
1-[[3-[(1S)-1-hydroxyethyl]phenoxy]methyl]cyclopentan-1-ol
CID 65212811
3-[(1-hydroxycyclohexyl)methoxy]benzonitrile
CID 65213745
1-[(3-butylphenoxy)methyl]cycloheptan-1-ol
CID 69097308
N-[(1-hydroxycyclohexyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 64866121

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol (CID 65213494) is 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol is COc1cccc(OCC2(O)CCCCC2)c1.
What is the InChIKey of 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol?
The InChIKey is RBILQMXAQXGLDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O3/c1-16-12-6-5-7-13(10-12)17-11-14(15)8-3-2-4-9-14/h5-7,10,15H,2-4,8-9,11H2,1H3.
What are the key properties of 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol?
1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol has a molecular weight of 236.31 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol is sourced from PubChem (CID 65213494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).