[(1S)-3-ethylidenecyclopentyl]methanol

C8H14O — CID 159536244

IUPAC[(1S)-3-ethylidenecyclopentyl]methanol
SMILESCC=C1CC[C@H](CO)C1
InChIInChI=1S/C8H14O/c1-2-7-3-4-8(5-7)6-9/h2,8-9H,3-6H2,1H3/t8-/m0/s1
InChIKeyBNCWBLLDUVQPPN-QMMMGPOBSA-N
MW126.20 g/mol
LogP1.73
Rot. Bonds1

About [(1S)-3-ethylidenecyclopentyl]methanol

[(1S)-3-ethylidenecyclopentyl]methanol (PubChem CID 159536244) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is [(1S)-3-ethylidenecyclopentyl]methanol.

Molecular Properties

Compound Name[(1S)-3-ethylidenecyclopentyl]methanol
PubChem CID159536244
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name[(1S)-3-ethylidenecyclopentyl]methanol
SMILESCC=C1CC[C@H](CO)C1
InChIInChI=1S/C8H14O/c1-2-7-3-4-8(5-7)6-9/h2,8-9H,3-6H2,1H3/t8-/m0/s1
InChIKeyBNCWBLLDUVQPPN-QMMMGPOBSA-N
XLogP1.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(1S)-3-ethylidenecyclopentyl]methanol?
The IUPAC name of [(1S)-3-ethylidenecyclopentyl]methanol (CID 159536244) is [(1S)-3-ethylidenecyclopentyl]methanol.
What is the SMILES notation for [(1S)-3-ethylidenecyclopentyl]methanol?
The canonical SMILES for [(1S)-3-ethylidenecyclopentyl]methanol is CC=C1CC[C@H](CO)C1.
What is the InChIKey of [(1S)-3-ethylidenecyclopentyl]methanol?
The InChIKey is BNCWBLLDUVQPPN-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H14O/c1-2-7-3-4-8(5-7)6-9/h2,8-9H,3-6H2,1H3/t8-/m0/s1.
What are the key properties of [(1S)-3-ethylidenecyclopentyl]methanol?
[(1S)-3-ethylidenecyclopentyl]methanol has a molecular weight of 126.20 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S)-3-ethylidenecyclopentyl]methanol is sourced from PubChem (CID 159536244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).