3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one

C10H12O2 — CID 145190678

IUPAC3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one
SMILESC=CC1=C(/C=C\C)C(=O)OC1C
InChIInChI=1S/C10H12O2/c1-4-6-9-8(5-2)7(3)12-10(9)11/h4-7H,2H2,1,3H3/b6-4-
InChIKeyPOEZTZFXVVVFNA-XQRVVYSFSA-N
MW164.20 g/mol
LogP1.99
Rot. Bonds2

About 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one

3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one (PubChem CID 145190678) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one.

Molecular Properties

Compound Name3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one
PubChem CID145190678
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one
SMILESC=CC1=C(/C=C\C)C(=O)OC1C
InChIInChI=1S/C10H12O2/c1-4-6-9-8(5-2)7(3)12-10(9)11/h4-7H,2H2,1,3H3/b6-4-
InChIKeyPOEZTZFXVVVFNA-XQRVVYSFSA-N
XLogP1.99
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-ethenyl-3-methyl-5-[(Z)-prop-1-enyl]-2,3-dihydropyran-4-one
CID 155711315
6-[(1Z)-buta-1,3-dienyl]-4-ethenyl-1,3,7-trimethyl-5-[(Z)-prop-1-enyl]-3H-azepin-2-one;ethane
CID 142050554
2,3-dimethyl-4-prop-2-enyl-2H-furan-5-one
CID 14200711
5-ethenyl-3,3,6-trimethyl-4-[(Z)-prop-1-enyl]-2,6-dihydropyran
CID 139549028
1-chloro-2-ethenyl-3-[(Z)-prop-1-enyl]-1H-indene
CID 145284483
2-benzofuran-1,3-dione;3-ethenyl-4-[(Z)-prop-1-enyl]furan-2,5-dione;methyliodanuidylmethane
CID 154693342
2,4-dimethyl-3-(2-methylprop-1-enyl)-2H-furan-5-one
CID 20820548
ethane;1,2,4-tris(ethenyl)-3-[(Z)-prop-1-enyl]cyclopenta-1,3-diene
CID 142480313
ethane;5-ethenyl-4-[(Z)-prop-1-enyl]-1,2-oxazol-3-one
CID 143109190
(3R)-2-ethenyl-3-methyl-1-[(Z)-prop-1-enyl]cyclohexene
CID 145347236
(5E)-5-[(Z)-but-2-enylidene]-2-ethenyl-6-methylidene-3-[(Z)-prop-1-enyl]cyclohex-2-ene-1,4-dione;ethane
CID 144875528
1,4,5-trimethyl-2,3-bis[(Z)-prop-1-enyl]cyclopenta-1,3-diene
CID 144989599

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one?
The IUPAC name of 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one (CID 145190678) is 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one.
What is the SMILES notation for 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one?
The canonical SMILES for 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one is C=CC1=C(/C=C\C)C(=O)OC1C.
What is the InChIKey of 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one?
The InChIKey is POEZTZFXVVVFNA-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H12O2/c1-4-6-9-8(5-2)7(3)12-10(9)11/h4-7H,2H2,1,3H3/b6-4-.
What are the key properties of 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one?
3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one has a molecular weight of 164.20 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]-2H-furan-5-one is sourced from PubChem (CID 145190678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).