1-(3-ethylcyclopentylidene)propan-2-ol

C10H18O — CID 103971144

IUPAC1-(3-ethylcyclopentylidene)propan-2-ol
SMILESCCC1CCC(=CC(C)O)C1
InChIInChI=1S/C10H18O/c1-3-9-4-5-10(7-9)6-8(2)11/h6,8-9,11H,3-5,7H2,1-2H3
InChIKeyCUHUIBKRIMMQBV-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.50
Rot. Bonds2

About 1-(3-ethylcyclopentylidene)propan-2-ol

1-(3-ethylcyclopentylidene)propan-2-ol (PubChem CID 103971144) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 1-(3-ethylcyclopentylidene)propan-2-ol.

Molecular Properties

Compound Name1-(3-ethylcyclopentylidene)propan-2-ol
PubChem CID103971144
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name1-(3-ethylcyclopentylidene)propan-2-ol
SMILESCCC1CCC(=CC(C)O)C1
InChIInChI=1S/C10H18O/c1-3-9-4-5-10(7-9)6-8(2)11/h6,8-9,11H,3-5,7H2,1-2H3
InChIKeyCUHUIBKRIMMQBV-UHFFFAOYSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.50
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 1-(3-ethylcyclopentylidene)propan-2-ol?
The IUPAC name of 1-(3-ethylcyclopentylidene)propan-2-ol (CID 103971144) is 1-(3-ethylcyclopentylidene)propan-2-ol.
What is the SMILES notation for 1-(3-ethylcyclopentylidene)propan-2-ol?
The canonical SMILES for 1-(3-ethylcyclopentylidene)propan-2-ol is CCC1CCC(=CC(C)O)C1.
What is the InChIKey of 1-(3-ethylcyclopentylidene)propan-2-ol?
The InChIKey is CUHUIBKRIMMQBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-3-9-4-5-10(7-9)6-8(2)11/h6,8-9,11H,3-5,7H2,1-2H3.
What are the key properties of 1-(3-ethylcyclopentylidene)propan-2-ol?
1-(3-ethylcyclopentylidene)propan-2-ol has a molecular weight of 154.25 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclopentylidene)propan-2-ol is sourced from PubChem (CID 103971144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).