2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol

C23H28O2 — CID 142370768

IUPAC2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol
SMILESOc1cc(-c2ccc(C3CCCC3)c(O)c2)ccc1C1CCCCC1
InChIInChI=1S/C23H28O2/c24-22-14-18(10-12-20(22)16-6-2-1-3-7-16)19-11-13-21(23(25)15-19)17-8-4-5-9-17/h10-17,24-25H,1-9H2
InChIKeySXTDBMVHLSBGOH-UHFFFAOYSA-N
MW336.48 g/mol
LogP6.47
Rot. Bonds3

About 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol

2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol (PubChem CID 142370768) has the molecular formula C23H28O2 and a molecular weight of 336.48 g/mol. Its IUPAC name is 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol.

Molecular Properties

Compound Name2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol
PubChem CID142370768
Molecular FormulaC23H28O2
Molecular Weight336.48 g/mol
Exact Mass336.21
IUPAC Name2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol
SMILESOc1cc(-c2ccc(C3CCCC3)c(O)c2)ccc1C1CCCCC1
InChIInChI=1S/C23H28O2/c24-22-14-18(10-12-20(22)16-6-2-1-3-7-16)19-11-13-21(23(25)15-19)17-8-4-5-9-17/h10-17,24-25H,1-9H2
InChIKeySXTDBMVHLSBGOH-UHFFFAOYSA-N
XLogP6.47
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.48
LogP ≤ 56.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-di(cyclononyl)phenol
CID 57426125
2-cycloheptyl-5-methylphenol
CID 45096882
4,6-dicyclohexylbenzene-1,3-diol
CID 3020817
2-cyclohexyl-5-(trifluoromethyl)phenol
CID 117104272
2-cyclododecylphenol
CID 22381643
1-(4-cyclohexyl-3-hydroxyphenyl)ethanone
CID 53423517
2-cyclopentyl-5-(trifluoromethyl)phenol
CID 117104152
1-chloro-4-(4-chloro-3-cyclohexylphenyl)-2-cyclohexylbenzene
CID 19787051
4-cyclohexyl-2,3-difluorophenol
CID 134218235
2-cycloheptyl-5-methylbenzene-1,4-diol
CID 59639034
2,3-dicyclohexylphenol;4-phenylphenol
CID 68975565
4-bromo-2-cyclohexylphenol
CID 22134516

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol?
The IUPAC name of 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol (CID 142370768) is 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol.
What is the SMILES notation for 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol?
The canonical SMILES for 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol is Oc1cc(-c2ccc(C3CCCC3)c(O)c2)ccc1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol?
The InChIKey is SXTDBMVHLSBGOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28O2/c24-22-14-18(10-12-20(22)16-6-2-1-3-7-16)19-11-13-21(23(25)15-19)17-8-4-5-9-17/h10-17,24-25H,1-9H2.
What are the key properties of 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol?
2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol has a molecular weight of 336.48 g/mol, XLogP of 6.47, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-(4-cyclopentyl-3-hydroxyphenyl)phenol is sourced from PubChem (CID 142370768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).