3-(4-benzylphenoxy)cyclohexan-1-ol

C19H22O2 — CID 79599479

IUPAC3-(4-benzylphenoxy)cyclohexan-1-ol
SMILESOC1CCCC(Oc2ccc(Cc3ccccc3)cc2)C1
InChIInChI=1S/C19H22O2/c20-17-7-4-8-19(14-17)21-18-11-9-16(10-12-18)13-15-5-2-1-3-6-15/h1-3,5-6,9-12,17,19-20H,4,7-8,13-14H2
InChIKeyUXCRLLZKCORWJG-UHFFFAOYSA-N
MW282.38 g/mol
LogP3.96
Rot. Bonds4

About 3-(4-benzylphenoxy)cyclohexan-1-ol

3-(4-benzylphenoxy)cyclohexan-1-ol (PubChem CID 79599479) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 3-(4-benzylphenoxy)cyclohexan-1-ol.

Molecular Properties

Compound Name3-(4-benzylphenoxy)cyclohexan-1-ol
PubChem CID79599479
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name3-(4-benzylphenoxy)cyclohexan-1-ol
SMILESOC1CCCC(Oc2ccc(Cc3ccccc3)cc2)C1
InChIInChI=1S/C19H22O2/c20-17-7-4-8-19(14-17)21-18-11-9-16(10-12-18)13-15-5-2-1-3-6-15/h1-3,5-6,9-12,17,19-20H,4,7-8,13-14H2
InChIKeyUXCRLLZKCORWJG-UHFFFAOYSA-N
XLogP3.96
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenoxycyclohexan-1-ol
CID 79617811
3-(4-chlorophenoxy)cyclohexan-1-ol
CID 123350797
trans-(1R,3R)-3-phenylmethoxycyclohexan-1-ol
CID 14172790
(3R)-3-(4-benzylphenoxy)piperidine
CID 26191511
4-(4-benzylphenoxy)oxane
CID 142700383
[4-[3-[4-(hydroxymethyl)phenoxy]cyclohexyl]oxyphenyl]methanol
CID 118229827
3-(3-hydroxycyclohexyl)oxyphenol
CID 117095404
3-(4-pyridin-3-ylphenoxy)cyclohexan-1-ol
CID 117051625
N-[[4-[3-[4-[(hydroxyamino)methyl]phenoxy]cyclohexyl]oxyphenyl]methyl]hydroxylamine
CID 19038365
2-(4-benzylphenoxy)cyclopentan-1-amine
CID 62274386
2-[[2-[6-[4-(3-hydroxycyclohexyl)oxyphenoxy]-3-pyridinyl]acetyl]amino]benzoic acid
CID 20602156
N-methyl-3-phenoxycyclohexan-1-amine
CID 79618884

Frequently Asked Questions

What is the IUPAC name of 3-(4-benzylphenoxy)cyclohexan-1-ol?
The IUPAC name of 3-(4-benzylphenoxy)cyclohexan-1-ol (CID 79599479) is 3-(4-benzylphenoxy)cyclohexan-1-ol.
What is the SMILES notation for 3-(4-benzylphenoxy)cyclohexan-1-ol?
The canonical SMILES for 3-(4-benzylphenoxy)cyclohexan-1-ol is OC1CCCC(Oc2ccc(Cc3ccccc3)cc2)C1.
What is the InChIKey of 3-(4-benzylphenoxy)cyclohexan-1-ol?
The InChIKey is UXCRLLZKCORWJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c20-17-7-4-8-19(14-17)21-18-11-9-16(10-12-18)13-15-5-2-1-3-6-15/h1-3,5-6,9-12,17,19-20H,4,7-8,13-14H2.
What are the key properties of 3-(4-benzylphenoxy)cyclohexan-1-ol?
3-(4-benzylphenoxy)cyclohexan-1-ol has a molecular weight of 282.38 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-benzylphenoxy)cyclohexan-1-ol is sourced from PubChem (CID 79599479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).