1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol

C13H24O — CID 118116828

IUPAC1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol
SMILESC=CC1(O)CCCC1C(CC)C(C)C
InChIInChI=1S/C13H24O/c1-5-11(10(3)4)12-8-7-9-13(12,14)6-2/h6,10-12,14H,2,5,7-9H2,1,3-4H3
InChIKeyDSEQBPZWTMDIIA-UHFFFAOYSA-N
MW196.33 g/mol
LogP3.39
Rot. Bonds4

About 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol

1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol (PubChem CID 118116828) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol
PubChem CID118116828
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol
SMILESC=CC1(O)CCCC1C(CC)C(C)C
InChIInChI=1S/C13H24O/c1-5-11(10(3)4)12-8-7-9-13(12,14)6-2/h6,10-12,14H,2,5,7-9H2,1,3-4H3
InChIKeyDSEQBPZWTMDIIA-UHFFFAOYSA-N
XLogP3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1,1-diethyl-2-(2-methylpentan-3-yl)cyclopentane
CID 123728511
1-ethenyl-2-hexylcyclopentan-1-ol
CID 118116896
2-[(E)-but-2-en-2-yl]-1-ethenylcyclohexan-1-ol
CID 134858730
1,2-bis(2-methylpentan-3-yl)cyclopentane
CID 91097416
trans-(1S,2R)-1-ethenyl-2-prop-2-enylcyclohexan-1-ol
CID 10702229
cis-(1R,2R)-1-methyl-2-propan-2-ylcyclopentan-1-ol
CID 158874958
cis-(1R,2R)-2-amino-1-ethenylcyclohexan-1-ol
CID 14219057
trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol
CID 10881406
2-butan-2-yl-1-ethylcyclohexan-1-ol
CID 154099705
(1S,2S,3R)-1-ethenyl-1-methyl-3-propan-2-yl-2-prop-1-en-2-ylcyclohexane
CID 163017053
1-butan-2-yl-1-methyl-2-propan-2-ylcyclopentane
CID 177219005
cis-(1R,2S)-2-ethenyl-1-propan-2-ylcyclopentan-1-ol
CID 102462779

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol?
The IUPAC name of 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol (CID 118116828) is 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol.
What is the SMILES notation for 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol?
The canonical SMILES for 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol is C=CC1(O)CCCC1C(CC)C(C)C.
What is the InChIKey of 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol?
The InChIKey is DSEQBPZWTMDIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O/c1-5-11(10(3)4)12-8-7-9-13(12,14)6-2/h6,10-12,14H,2,5,7-9H2,1,3-4H3.
What are the key properties of 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol?
1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol has a molecular weight of 196.33 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2-(2-methylpentan-3-yl)cyclopentan-1-ol is sourced from PubChem (CID 118116828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).