4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol

C12H18O — CID 142618294

IUPAC4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol
SMILESOC1CCC(C2=CCCC=C2)CC1
InChIInChI=1S/C12H18O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h2,4-5,11-13H,1,3,6-9H2
InChIKeyRYWQPYLRAQXEIT-UHFFFAOYSA-N
MW178.27 g/mol
LogP2.81
Rot. Bonds1

About 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol

4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol (PubChem CID 142618294) has the molecular formula C12H18O and a molecular weight of 178.27 g/mol. Its IUPAC name is 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol.

Molecular Properties

Compound Name4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol
PubChem CID142618294
Molecular FormulaC12H18O
Molecular Weight178.27 g/mol
Exact Mass178.14
IUPAC Name4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol
SMILESOC1CCC(C2=CCCC=C2)CC1
InChIInChI=1S/C12H18O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h2,4-5,11-13H,1,3,6-9H2
InChIKeyRYWQPYLRAQXEIT-UHFFFAOYSA-N
XLogP2.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.27
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-methylperoxycyclohexyl)cyclohexa-1,3-diene
CID 144554520
1-(4-cyclohexa-1,5-dien-1-ylcyclohexyl)-N-methylmethanamine
CID 142280064
methyl 4-cyclohexa-1,5-dien-1-ylpiperidine-1-carboxylate
CID 173044728
2-[2-(4-cyclohexa-1,5-dien-1-ylpiperidin-1-yl)ethylamino]phenol
CID 153396697
N-(4-cyclohexa-1,5-dien-1-ylcyclohexyl)-N,N'-dimethyl-N'-phenylethane-1,2-diamine
CID 141045804
6-cyclohexa-1,5-dien-1-yl-2-(hydroxymethyl)oxane-3,4-diol
CID 171556673
6-cyclohexa-1,5-dien-1-ylcyclohex-2-en-1-amine
CID 88997048
4-cyclohexa-1,5-dien-1-yl-N-ethyl-N-[(2R)-4-phenylbutan-2-yl]cyclohexan-1-amine
CID 141045791
(2R,7aS)-2,6,7,7a-tetrahydro-1H-inden-2-ol
CID 102412442
5-cyclopropylcyclohepta-1,4,6-trien-1-amine
CID 138489498
3-cyclohexa-1,5-dien-1-yloxirane-2-carboxylic acid
CID 118884274
4-(2-cyclohexa-1,5-dien-1-ylcyclohexyl)piperidine
CID 174764120

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol?
The IUPAC name of 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol (CID 142618294) is 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol.
What is the SMILES notation for 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol?
The canonical SMILES for 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol is OC1CCC(C2=CCCC=C2)CC1.
What is the InChIKey of 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol?
The InChIKey is RYWQPYLRAQXEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h2,4-5,11-13H,1,3,6-9H2.
What are the key properties of 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol?
4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol has a molecular weight of 178.27 g/mol, XLogP of 2.81, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexa-1,5-dien-1-ylcyclohexan-1-ol is sourced from PubChem (CID 142618294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).