4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one

C10H12N2O — CID 143009973

IUPAC4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one
SMILESC=Cc1[nH]c(=O)n(C(=C)C)c1C=C
InChIInChI=1S/C10H12N2O/c1-5-8-9(6-2)12(7(3)4)10(13)11-8/h5-6H,1-3H2,4H3,(H,11,13)
InChIKeyXRALVNRRIHGWEW-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.95
Rot. Bonds3

About 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one

4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one (PubChem CID 143009973) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one.

Molecular Properties

Compound Name4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one
PubChem CID143009973
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one
SMILESC=Cc1[nH]c(=O)n(C(=C)C)c1C=C
InChIInChI=1S/C10H12N2O/c1-5-8-9(6-2)12(7(3)4)10(13)11-8/h5-6H,1-3H2,4H3,(H,11,13)
InChIKeyXRALVNRRIHGWEW-UHFFFAOYSA-N
XLogP1.95
TPSA37.79 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one?
The IUPAC name of 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one (CID 143009973) is 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one.
What is the SMILES notation for 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one?
The canonical SMILES for 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one is C=Cc1[nH]c(=O)n(C(=C)C)c1C=C.
What is the InChIKey of 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one?
The InChIKey is XRALVNRRIHGWEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-5-8-9(6-2)12(7(3)4)10(13)11-8/h5-6H,1-3H2,4H3,(H,11,13).
What are the key properties of 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one?
4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one has a molecular weight of 176.22 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(ethenyl)-3-prop-1-en-2-yl-1H-imidazol-2-one is sourced from PubChem (CID 143009973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).