(1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol

C19H30O2 — CID 46914940

IUPAC(1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol
SMILESO[C@H](CCC[C@@H](O)C1CCCCC1)CCc1ccccc1
InChIInChI=1S/C19H30O2/c20-18(15-14-16-8-3-1-4-9-16)12-7-13-19(21)17-10-5-2-6-11-17/h1,3-4,8-9,17-21H,2,5-7,10-15H2/t18-,19-/m1/s1
InChIKeyLHHUFMLAHDXGEP-RTBURBONSA-N
MW290.45 g/mol
LogP4.09
Rot. Bonds8

About (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol

(1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol (PubChem CID 46914940) has the molecular formula C19H30O2 and a molecular weight of 290.45 g/mol. Its IUPAC name is (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol.

Molecular Properties

Compound Name(1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol
PubChem CID46914940
Molecular FormulaC19H30O2
Molecular Weight290.45 g/mol
Exact Mass290.22
IUPAC Name(1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol
SMILESO[C@H](CCC[C@@H](O)C1CCCCC1)CCc1ccccc1
InChIInChI=1S/C19H30O2/c20-18(15-14-16-8-3-1-4-9-16)12-7-13-19(21)17-10-5-2-6-11-17/h1,3-4,8-9,17-21H,2,5-7,10-15H2/t18-,19-/m1/s1
InChIKeyLHHUFMLAHDXGEP-RTBURBONSA-N
XLogP4.09
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol 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

(1R)-1-cyclopentyl-3-phenylpropan-1-ol
CID 15361902
(1S,5R)-1-cyclohexyl-5-phenylpentane-1,5-diol
CID 46915097
3,3-dicyclohexylpropylbenzene
CID 86671113
1,5-diphenylpentan-3-ol;hydrochloride
CID 139805992
(1R)-1-cyclopentyl-2-phenylethanol
CID 39238299
[(3R)-3-cyclohexylbutyl]benzene
CID 102579407
1-cycloheptyl-3-phenylpropan-1-amine
CID 65399790
1-phenylheptan-3-ol
CID 10420110
1-(4-tert-butylcyclohexyl)-4-phenylbutan-1-ol
CID 65401121
1-cyclooctyl-3-(4-methoxyphenyl)propan-1-ol
CID 80603730
1-cycloheptyl-3-phenoxypropan-1-ol
CID 82931193
(1-cyclohexyl-3-phenylpropyl)hydrazine
CID 105201730

Frequently Asked Questions

What is the IUPAC name of (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol?
The IUPAC name of (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol (CID 46914940) is (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol.
What is the SMILES notation for (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol?
The canonical SMILES for (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol is O[C@H](CCC[C@@H](O)C1CCCCC1)CCc1ccccc1.
What is the InChIKey of (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol?
The InChIKey is LHHUFMLAHDXGEP-RTBURBONSA-N. The full InChI is InChI=1S/C19H30O2/c20-18(15-14-16-8-3-1-4-9-16)12-7-13-19(21)17-10-5-2-6-11-17/h1,3-4,8-9,17-21H,2,5-7,10-15H2/t18-,19-/m1/s1.
What are the key properties of (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol?
(1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol has a molecular weight of 290.45 g/mol, XLogP of 4.09, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5R)-1-cyclohexyl-7-phenylheptane-1,5-diol is sourced from PubChem (CID 46914940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).