1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol

C18H28O2 — CID 116756419

IUPAC1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol
SMILESCOC(C(O)CCCc1ccccc1)C1CCCCC1
InChIInChI=1S/C18H28O2/c1-20-18(16-12-6-3-7-13-16)17(19)14-8-11-15-9-4-2-5-10-15/h2,4-5,9-10,16-19H,3,6-8,11-14H2,1H3
InChIKeyGRLYWLKTFCWKJH-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.97
Rot. Bonds7

About 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol

1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol (PubChem CID 116756419) has the molecular formula C18H28O2 and a molecular weight of 276.42 g/mol. Its IUPAC name is 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol.

Molecular Properties

Compound Name1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol
PubChem CID116756419
Molecular FormulaC18H28O2
Molecular Weight276.42 g/mol
Exact Mass276.21
IUPAC Name1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol
SMILESCOC(C(O)CCCc1ccccc1)C1CCCCC1
InChIInChI=1S/C18H28O2/c1-20-18(16-12-6-3-7-13-16)17(19)14-8-11-15-9-4-2-5-10-15/h2,4-5,9-10,16-19H,3,6-8,11-14H2,1H3
InChIKeyGRLYWLKTFCWKJH-UHFFFAOYSA-N
XLogP3.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclohexyl-1-methoxy-5-phenylpentan-2-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-cyclopropyl-1-methoxy-N-methyl-5-phenylpentan-2-amine
CID 116722293
1-cyclohexyl-1-methoxydodecan-2-ol
CID 116756363
1-cyclohexyl-3-(3-fluorophenyl)-1-methoxypropan-2-ol
CID 116756361
3-phenylpropyl (5R,6R)-6-cyclohexyl-6-methoxy-5-methylhex-3-enoate
CID 6636822
(1R)-1-cyclopentyl-3-phenylpropan-1-ol
CID 15361902
1-cyclohexyl-1-methoxynon-8-en-2-ol
CID 107008733
[(3R)-3-cyclohexylbutyl]benzene
CID 102579407
3,3-dicyclohexylpropylbenzene
CID 86671113
(1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol
CID 46914940
cyclohexyl(phenylmethoxy)methanol
CID 54334195
[3-(cyclohexylmethyl)-6-phenylhexyl]benzene
CID 173252623
1-cyclohexyl-1-methoxy-4-methylpentan-2-ol
CID 116756323

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol?
The IUPAC name of 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol (CID 116756419) is 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol.
What is the SMILES notation for 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol?
The canonical SMILES for 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol is COC(C(O)CCCc1ccccc1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol?
The InChIKey is GRLYWLKTFCWKJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28O2/c1-20-18(16-12-6-3-7-13-16)17(19)14-8-11-15-9-4-2-5-10-15/h2,4-5,9-10,16-19H,3,6-8,11-14H2,1H3.
What are the key properties of 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol?
1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol has a molecular weight of 276.42 g/mol, XLogP of 3.97, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-methoxy-5-phenylpentan-2-ol is sourced from PubChem (CID 116756419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).