cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol

C19H30O — CID 63426584

IUPACcyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol
SMILESCC(C)c1ccc(C(O)C2CCCCC2)c(C(C)C)c1
InChIInChI=1S/C19H30O/c1-13(2)16-10-11-17(18(12-16)14(3)4)19(20)15-8-6-5-7-9-15/h10-15,19-20H,5-9H2,1-4H3
InChIKeyUKGBMLLVQBUIOI-UHFFFAOYSA-N
MW274.45 g/mol
LogP5.55
Rot. Bonds4

About cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol

cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol (PubChem CID 63426584) has the molecular formula C19H30O and a molecular weight of 274.45 g/mol. Its IUPAC name is cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol.

Molecular Properties

Compound Namecyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol
PubChem CID63426584
Molecular FormulaC19H30O
Molecular Weight274.45 g/mol
Exact Mass274.23
IUPAC Namecyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol
SMILESCC(C)c1ccc(C(O)C2CCCCC2)c(C(C)C)c1
InChIInChI=1S/C19H30O/c1-13(2)16-10-11-17(18(12-16)14(3)4)19(20)15-8-6-5-7-9-15/h10-15,19-20H,5-9H2,1-4H3
InChIKeyUKGBMLLVQBUIOI-UHFFFAOYSA-N
XLogP5.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.45
LogP ≤ 55.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopentyl-1-[2,4-di(propan-2-yl)phenyl]ethanol
CID 63426963
[2,4-di(propan-2-yl)phenyl]-(2-methylcyclopentyl)methanol
CID 107181587
[2,4-di(propan-2-yl)phenyl]-(oxan-2-yl)methanol
CID 62214641
cyclobutyl-[2,4-di(propan-2-yl)phenyl]methanamine
CID 43103205
1-cyclopentyl-1-[2,4-di(propan-2-yl)phenyl]-N-methylmethanamine
CID 43484503
N-cyclohexyl-2,5-di(propan-2-yl)aniline
CID 170213032
cycloheptyl-(2,4-dimethylphenyl)methanol
CID 55199424
N-[cyclobutyl-[2,4-di(propan-2-yl)phenyl]methyl]ethanamine
CID 43491289
(1R)-2-chloro-1-[2,4-di(propan-2-yl)phenyl]ethanol
CID 25324257
(2-bromo-4-methylphenyl)-cycloheptylmethanol
CID 82928098
cyclohexyl-(2-fluoro-4-methylphenyl)methanol
CID 115802084
1-[2,4-di(propan-2-yl)phenyl]-2,2-difluoroethanol
CID 113435253

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol?
The IUPAC name of cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol (CID 63426584) is cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol.
What is the SMILES notation for cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol?
The canonical SMILES for cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol is CC(C)c1ccc(C(O)C2CCCCC2)c(C(C)C)c1.
What is the InChIKey of cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol?
The InChIKey is UKGBMLLVQBUIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30O/c1-13(2)16-10-11-17(18(12-16)14(3)4)19(20)15-8-6-5-7-9-15/h10-15,19-20H,5-9H2,1-4H3.
What are the key properties of cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol?
cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol has a molecular weight of 274.45 g/mol, XLogP of 5.55, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[2,4-di(propan-2-yl)phenyl]methanol is sourced from PubChem (CID 63426584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).