[(3S)-3-ethenylcyclopentyl]methanol

C8H14O — CID 143479645

IUPAC[(3S)-3-ethenylcyclopentyl]methanol
SMILESC=C[C@H]1CCC(CO)C1
InChIInChI=1S/C8H14O/c1-2-7-3-4-8(5-7)6-9/h2,7-9H,1,3-6H2/t7-,8?/m0/s1
InChIKeyYLNQAFBOSRFDIB-JAMMHHFISA-N
MW126.20 g/mol
LogP1.58
Rot. Bonds2

About [(3S)-3-ethenylcyclopentyl]methanol

[(3S)-3-ethenylcyclopentyl]methanol (PubChem CID 143479645) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is [(3S)-3-ethenylcyclopentyl]methanol.

Molecular Properties

Compound Name[(3S)-3-ethenylcyclopentyl]methanol
PubChem CID143479645
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name[(3S)-3-ethenylcyclopentyl]methanol
SMILESC=C[C@H]1CCC(CO)C1
InChIInChI=1S/C8H14O/c1-2-7-3-4-8(5-7)6-9/h2,7-9H,1,3-6H2/t7-,8?/m0/s1
InChIKeyYLNQAFBOSRFDIB-JAMMHHFISA-N
XLogP1.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.58
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

3-Methyl-6-hepten-1-ol
CID 543353
[(1R,2S)-2-ethenylcyclopentyl]methanol
CID 11051660
Diallylpropylcarbinol
CID 88445282
5-Methyl-6-hepten-1-ol
CID 543351
(3-Methylenecyclopentyl)methanol
CID 556397
[(1R,2R)-2-ethenylcyclopentyl]methanol
CID 10953508
(4R)-4-ethylhex-5-en-1-ol
CID 101460600
(3R)-3-ethenylhexan-1-ol
CID 134906001
(3R)-3-methylhept-6-en-1-ol
CID 11768592
(2-Ethenylcyclopentyl)methanol
CID 13161112
(3S)-3-methylhept-6-en-1-ol
CID 11007922
3-(2-Propenyl)-cyclopentanol
CID 11094623

Frequently Asked Questions

What is the IUPAC name of [(3S)-3-ethenylcyclopentyl]methanol?
The IUPAC name of [(3S)-3-ethenylcyclopentyl]methanol (CID 143479645) is [(3S)-3-ethenylcyclopentyl]methanol.
What is the SMILES notation for [(3S)-3-ethenylcyclopentyl]methanol?
The canonical SMILES for [(3S)-3-ethenylcyclopentyl]methanol is C=C[C@H]1CCC(CO)C1.
What is the InChIKey of [(3S)-3-ethenylcyclopentyl]methanol?
The InChIKey is YLNQAFBOSRFDIB-JAMMHHFISA-N. The full InChI is InChI=1S/C8H14O/c1-2-7-3-4-8(5-7)6-9/h2,7-9H,1,3-6H2/t7-,8?/m0/s1.
What are the key properties of [(3S)-3-ethenylcyclopentyl]methanol?
[(3S)-3-ethenylcyclopentyl]methanol has a molecular weight of 126.20 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-3-ethenylcyclopentyl]methanol is sourced from PubChem (CID 143479645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).