2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol

C17H26O2 — CID 62383408

IUPAC2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol
SMILESCc1ccc(C(O)C(C)OCC2CCCCC2)cc1
InChIInChI=1S/C17H26O2/c1-13-8-10-16(11-9-13)17(18)14(2)19-12-15-6-4-3-5-7-15/h8-11,14-15,17-18H,3-7,12H2,1-2H3
InChIKeyNTDPPGLKZLDAGQ-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.01
Rot. Bonds5

About 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol

2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol (PubChem CID 62383408) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol
PubChem CID62383408
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol
SMILESCc1ccc(C(O)C(C)OCC2CCCCC2)cc1
InChIInChI=1S/C17H26O2/c1-13-8-10-16(11-9-13)17(18)14(2)19-12-15-6-4-3-5-7-15/h8-11,14-15,17-18H,3-7,12H2,1-2H3
InChIKeyNTDPPGLKZLDAGQ-UHFFFAOYSA-N
XLogP4.01
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopentylmethoxy)-1-(4-methylphenyl)propan-1-ol
CID 66322023
2-(cyclohexylmethoxy)-1-phenylpropan-1-ol
CID 62383236
1-[2-bromo-1-(cyclopentylmethoxy)ethyl]-4-methylbenzene
CID 66321621
2-(oxan-4-ylmethoxy)-1-phenylpropan-1-ol
CID 62383931
1-(cyclohexylmethoxy)-1-(4-methylphenyl)butan-2-amine
CID 62383299
2-(cyclohexylmethoxy)-1-phenylbutan-1-ol
CID 62383401
N-[2-(cyclopentylmethoxy)-2-(4-methylphenyl)ethyl]cyclopropanamine
CID 66322051
2-(3,3-dimethylbutoxy)-1-(4-methylphenyl)propan-1-ol
CID 66224938
4-[1-(cyclohexylmethoxy)ethyl]aniline
CID 57106208
N-ethyl-1-(4-methylphenyl)-2-(oxan-4-ylmethoxy)propan-1-amine
CID 62383540
2-(cyclohexylmethoxy)-N-ethyl-1-phenylpropan-1-amine
CID 62383534
1-(cyclopentylmethoxy)ethylbenzene
CID 90167891

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol?
The IUPAC name of 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol (CID 62383408) is 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol.
What is the SMILES notation for 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol?
The canonical SMILES for 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol is Cc1ccc(C(O)C(C)OCC2CCCCC2)cc1.
What is the InChIKey of 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol?
The InChIKey is NTDPPGLKZLDAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-13-8-10-16(11-9-13)17(18)14(2)19-12-15-6-4-3-5-7-15/h8-11,14-15,17-18H,3-7,12H2,1-2H3.
What are the key properties of 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol?
2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol has a molecular weight of 262.39 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethoxy)-1-(4-methylphenyl)propan-1-ol is sourced from PubChem (CID 62383408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).