4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide

C12H14N2O2 — CID 69404218

IUPAC4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide
SMILESC=Cc1ccc(C(N)=O)c(C(=O)N(C)C)c1
InChIInChI=1S/C12H14N2O2/c1-4-8-5-6-9(11(13)15)10(7-8)12(16)14(2)3/h4-7H,1H2,2-3H3,(H2,13,15)
InChIKeyQZOGBYNLEIQEMR-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.13
Rot. Bonds3

About 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide

4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide (PubChem CID 69404218) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide.

Molecular Properties

Compound Name4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide
PubChem CID69404218
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide
SMILESC=Cc1ccc(C(N)=O)c(C(=O)N(C)C)c1
InChIInChI=1S/C12H14N2O2/c1-4-8-5-6-9(11(13)15)10(7-8)12(16)14(2)3/h4-7H,1H2,2-3H3,(H2,13,15)
InChIKeyQZOGBYNLEIQEMR-UHFFFAOYSA-N
XLogP1.13
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide?
The IUPAC name of 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide (CID 69404218) is 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide.
What is the SMILES notation for 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide?
The canonical SMILES for 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide is C=Cc1ccc(C(N)=O)c(C(=O)N(C)C)c1.
What is the InChIKey of 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide?
The InChIKey is QZOGBYNLEIQEMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-4-8-5-6-9(11(13)15)10(7-8)12(16)14(2)3/h4-7H,1H2,2-3H3,(H2,13,15).
What are the key properties of 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide?
4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide has a molecular weight of 218.26 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-N,2-N-dimethylbenzene-1,2-dicarboxamide is sourced from PubChem (CID 69404218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).