4-cyclopentylhexa-4,5-dien-3-ol

C11H18O — CID 130125116

IUPAC4-cyclopentylhexa-4,5-dien-3-ol
SMILESC=C=C(C(O)CC)C1CCCC1
InChIInChI=1S/C11H18O/c1-3-10(11(12)4-2)9-7-5-6-8-9/h9,11-12H,1,4-8H2,2H3
InChIKeyNFWAQHMYPQDRMI-UHFFFAOYSA-N
MW166.26 g/mol
LogP2.66
Rot. Bonds3

About 4-cyclopentylhexa-4,5-dien-3-ol

4-cyclopentylhexa-4,5-dien-3-ol (PubChem CID 130125116) has the molecular formula C11H18O and a molecular weight of 166.26 g/mol. Its IUPAC name is 4-cyclopentylhexa-4,5-dien-3-ol.

Molecular Properties

Compound Name4-cyclopentylhexa-4,5-dien-3-ol
PubChem CID130125116
Molecular FormulaC11H18O
Molecular Weight166.26 g/mol
Exact Mass166.14
IUPAC Name4-cyclopentylhexa-4,5-dien-3-ol
SMILESC=C=C(C(O)CC)C1CCCC1
InChIInChI=1S/C11H18O/c1-3-10(11(12)4-2)9-7-5-6-8-9/h9,11-12H,1,4-8H2,2H3
InChIKeyNFWAQHMYPQDRMI-UHFFFAOYSA-N
XLogP2.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.26
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Methylidene-5-(prop-1-en-2-yl)cyclohexan-1-ol
CID 527427
Cyclohexanol, 2-methylene-5-(1-methylethenyl)-, (1S-cis)-
CID 12642439
cis-p-Mentha-1(7),8-dien-2-ol
CID 6429040
trans-1(7),8-p-Menthadien-2-ol
CID 6428442
7-Octene-1,6-diol, 3,7-dimethyl-
CID 90790
FT-0671749
CID 11400874
cis-1(7),8-p-Menthadien-2-ol
CID 6428440
Cyclopentanepropanol, 2-methylene-
CID 556392
1-Cyclohexylbuta-2,3-dien-1-ol
CID 10942646
2-Methyl-1-nonen-3-ol
CID 13919198
2-Ethylnon-1-en-3-ol
CID 558893
7-Octen-1-ol, 6-hydroperoxy-3,7-dimethyl-
CID 11171459

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentylhexa-4,5-dien-3-ol?
The IUPAC name of 4-cyclopentylhexa-4,5-dien-3-ol (CID 130125116) is 4-cyclopentylhexa-4,5-dien-3-ol.
What is the SMILES notation for 4-cyclopentylhexa-4,5-dien-3-ol?
The canonical SMILES for 4-cyclopentylhexa-4,5-dien-3-ol is C=C=C(C(O)CC)C1CCCC1.
What is the InChIKey of 4-cyclopentylhexa-4,5-dien-3-ol?
The InChIKey is NFWAQHMYPQDRMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O/c1-3-10(11(12)4-2)9-7-5-6-8-9/h9,11-12H,1,4-8H2,2H3.
What are the key properties of 4-cyclopentylhexa-4,5-dien-3-ol?
4-cyclopentylhexa-4,5-dien-3-ol has a molecular weight of 166.26 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentylhexa-4,5-dien-3-ol is sourced from PubChem (CID 130125116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).