(2-methylcyclopentylidene)methanone

C7H10O — CID 154126174

IUPAC(2-methylcyclopentylidene)methanone
SMILESCC1CCCC1=C=O
InChIInChI=1S/C7H10O/c1-6-3-2-4-7(6)5-8/h6H,2-4H2,1H3
InChIKeyAOVIBIYCLAPWBO-UHFFFAOYSA-N
MW110.16 g/mol
LogP1.56
Rot. Bonds

About (2-methylcyclopentylidene)methanone

(2-methylcyclopentylidene)methanone (PubChem CID 154126174) has the molecular formula C7H10O and a molecular weight of 110.16 g/mol. Its IUPAC name is (2-methylcyclopentylidene)methanone.

Molecular Properties

Compound Name(2-methylcyclopentylidene)methanone
PubChem CID154126174
Molecular FormulaC7H10O
Molecular Weight110.16 g/mol
Exact Mass110.07
IUPAC Name(2-methylcyclopentylidene)methanone
SMILESCC1CCCC1=C=O
InChIInChI=1S/C7H10O/c1-6-3-2-4-7(6)5-8/h6H,2-4H2,1H3
InChIKeyAOVIBIYCLAPWBO-UHFFFAOYSA-N
XLogP1.56
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopentylidene)methanone?
The IUPAC name of (2-methylcyclopentylidene)methanone (CID 154126174) is (2-methylcyclopentylidene)methanone.
What is the SMILES notation for (2-methylcyclopentylidene)methanone?
The canonical SMILES for (2-methylcyclopentylidene)methanone is CC1CCCC1=C=O.
What is the InChIKey of (2-methylcyclopentylidene)methanone?
The InChIKey is AOVIBIYCLAPWBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O/c1-6-3-2-4-7(6)5-8/h6H,2-4H2,1H3.
What are the key properties of (2-methylcyclopentylidene)methanone?
(2-methylcyclopentylidene)methanone has a molecular weight of 110.16 g/mol, XLogP of 1.56, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclopentylidene)methanone is sourced from PubChem (CID 154126174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).