2-(2-methoxyprop-2-enyl)cyclopentan-1-one

C9H14O2 — CID 11084087

IUPAC2-(2-methoxyprop-2-enyl)cyclopentan-1-one
SMILESC=C(CC1CCCC1=O)OC
InChIInChI=1S/C9H14O2/c1-7(11-2)6-8-4-3-5-9(8)10/h8H,1,3-6H2,2H3
InChIKeyWVWUQRNVSZRLCQ-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.91
Rot. Bonds3

About 2-(2-methoxyprop-2-enyl)cyclopentan-1-one

2-(2-methoxyprop-2-enyl)cyclopentan-1-one (PubChem CID 11084087) has the molecular formula C9H14O2 and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-(2-methoxyprop-2-enyl)cyclopentan-1-one.

Molecular Properties

Compound Name2-(2-methoxyprop-2-enyl)cyclopentan-1-one
PubChem CID11084087
Molecular FormulaC9H14O2
Molecular Weight154.21 g/mol
Exact Mass154.10
IUPAC Name2-(2-methoxyprop-2-enyl)cyclopentan-1-one
SMILESC=C(CC1CCCC1=O)OC
InChIInChI=1S/C9H14O2/c1-7(11-2)6-8-4-3-5-9(8)10/h8H,1,3-6H2,2H3
InChIKeyWVWUQRNVSZRLCQ-UHFFFAOYSA-N
XLogP1.91
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze 2-(2-methoxyprop-2-enyl)cyclopentan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(1-Methoxyethenyl)cyclopentan-1-one
CID 90982761
4-(1-Methoxyethenyl)cyclohexan-1-one
CID 123611307
2-(1-Methoxyethenyl)cyclopentan-1-one
CID 143441058
3-(5-Methoxy-3-methylhex-5-en-2-yl)cyclopentan-1-one
CID 146654109
(3R)-3-(cyclopentylmethyl)-5-methoxyhex-5-en-2-one
CID 162206745
2-(3,4-dihydro-2H-pyran-5-yl)cyclopentan-1-one
CID 11768911
2-(2-Ethoxy-2-propenyl)cyclohexanone
CID 24972180
2-(2-Ethoxy-2-propenyl)-2-methyl-1,3-cyclopentanedione
CID 24972300
2-(2-Pent-4-enoxyethyl)cyclopentan-1-one
CID 79564959
2-[2-(3-Methylbut-3-enoxy)ethyl]cyclopentan-1-one
CID 114470358
Methyl 2-(3-methylidene-2-oxocyclopentyl)acetate
CID 130029714
3-(1-Methoxyethenyl)cyclohexan-1-one
CID 130038001

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyprop-2-enyl)cyclopentan-1-one?
The IUPAC name of 2-(2-methoxyprop-2-enyl)cyclopentan-1-one (CID 11084087) is 2-(2-methoxyprop-2-enyl)cyclopentan-1-one.
What is the SMILES notation for 2-(2-methoxyprop-2-enyl)cyclopentan-1-one?
The canonical SMILES for 2-(2-methoxyprop-2-enyl)cyclopentan-1-one is C=C(CC1CCCC1=O)OC.
What is the InChIKey of 2-(2-methoxyprop-2-enyl)cyclopentan-1-one?
The InChIKey is WVWUQRNVSZRLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O2/c1-7(11-2)6-8-4-3-5-9(8)10/h8H,1,3-6H2,2H3.
What are the key properties of 2-(2-methoxyprop-2-enyl)cyclopentan-1-one?
2-(2-methoxyprop-2-enyl)cyclopentan-1-one has a molecular weight of 154.21 g/mol, XLogP of 1.91, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyprop-2-enyl)cyclopentan-1-one is sourced from PubChem (CID 11084087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).