4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol

C12H20O — CID 121014186

IUPAC4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol
SMILESCC(C)=CC(C)(C)C1C=CC(O)C1
InChIInChI=1S/C12H20O/c1-9(2)8-12(3,4)10-5-6-11(13)7-10/h5-6,8,10-11,13H,7H2,1-4H3
InChIKeyCSFBBHCXRVJEIJ-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.92
Rot. Bonds2

About 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol

4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol (PubChem CID 121014186) has the molecular formula C12H20O and a molecular weight of 180.29 g/mol. Its IUPAC name is 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol.

Molecular Properties

Compound Name4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol
PubChem CID121014186
Molecular FormulaC12H20O
Molecular Weight180.29 g/mol
Exact Mass180.15
IUPAC Name4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol
SMILESCC(C)=CC(C)(C)C1C=CC(O)C1
InChIInChI=1S/C12H20O/c1-9(2)8-12(3,4)10-5-6-11(13)7-10/h5-6,8,10-11,13H,7H2,1-4H3
InChIKeyCSFBBHCXRVJEIJ-UHFFFAOYSA-N
XLogP2.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.92
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 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol?
The IUPAC name of 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol (CID 121014186) is 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol.
What is the SMILES notation for 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol?
The canonical SMILES for 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol is CC(C)=CC(C)(C)C1C=CC(O)C1.
What is the InChIKey of 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol?
The InChIKey is CSFBBHCXRVJEIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O/c1-9(2)8-12(3,4)10-5-6-11(13)7-10/h5-6,8,10-11,13H,7H2,1-4H3.
What are the key properties of 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol?
4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol has a molecular weight of 180.29 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethylpent-3-en-2-yl)cyclopent-2-en-1-ol is sourced from PubChem (CID 121014186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).