3-N-ethenylbenzene-1,3-dicarboxamide

C10H10N2O2 — CID 68671351

IUPAC3-N-ethenylbenzene-1,3-dicarboxamide
SMILESC=CNC(=O)c1cccc(C(N)=O)c1
InChIInChI=1S/C10H10N2O2/c1-2-12-10(14)8-5-3-4-7(6-8)9(11)13/h2-6H,1H2,(H2,11,13)(H,12,14)
InChIKeyXQDCSKOKNMYCRY-UHFFFAOYSA-N
MW190.20 g/mol
LogP0.66
Rot. Bonds3

About 3-N-ethenylbenzene-1,3-dicarboxamide

3-N-ethenylbenzene-1,3-dicarboxamide (PubChem CID 68671351) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 3-N-ethenylbenzene-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-ethenylbenzene-1,3-dicarboxamide
PubChem CID68671351
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name3-N-ethenylbenzene-1,3-dicarboxamide
SMILESC=CNC(=O)c1cccc(C(N)=O)c1
InChIInChI=1S/C10H10N2O2/c1-2-12-10(14)8-5-3-4-7(6-8)9(11)13/h2-6H,1H2,(H2,11,13)(H,12,14)
InChIKeyXQDCSKOKNMYCRY-UHFFFAOYSA-N
XLogP0.66
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-N-ethenylbenzene-1,3-dicarboxamide 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-[[(4-carbamoylbenzoyl)amino]carbamoyl]benzamide
CID 139830477
3-carbamoylbenzoic acid
CID 3014284
3-(methylamino)benzamide
CID 18727714
3-N-[(2R)-3-methylbutan-2-yl]benzene-1,3-dicarboxamide
CID 30827773
3-N-(1-amino-4-methylpentan-2-yl)benzene-1,3-dicarboxamide;hydrochloride
CID 119587745
3-N-(1-aminobutan-2-yl)benzene-1,3-dicarboxamide
CID 65193984
methyl 3-[(3-carbamoylbenzoyl)amino]propanoate
CID 47159745
ethane;3-(methylamino)benzamide
CID 142071023
3-N-(3-chlorophenyl)benzene-1,3-dicarboxamide
CID 35554073
3-N,3-N-bis(1-hydroxyprop-2-enyl)benzene-1,3-dicarboxamide
CID 70362816
3-N-(2-amino-2-methylpropyl)benzene-1,3-dicarboxamide
CID 81482947
3-carbamothioyl-N-(3-carbamoylphenyl)benzamide
CID 107811391

Frequently Asked Questions

What is the IUPAC name of 3-N-ethenylbenzene-1,3-dicarboxamide?
The IUPAC name of 3-N-ethenylbenzene-1,3-dicarboxamide (CID 68671351) is 3-N-ethenylbenzene-1,3-dicarboxamide.
What is the SMILES notation for 3-N-ethenylbenzene-1,3-dicarboxamide?
The canonical SMILES for 3-N-ethenylbenzene-1,3-dicarboxamide is C=CNC(=O)c1cccc(C(N)=O)c1.
What is the InChIKey of 3-N-ethenylbenzene-1,3-dicarboxamide?
The InChIKey is XQDCSKOKNMYCRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-2-12-10(14)8-5-3-4-7(6-8)9(11)13/h2-6H,1H2,(H2,11,13)(H,12,14).
What are the key properties of 3-N-ethenylbenzene-1,3-dicarboxamide?
3-N-ethenylbenzene-1,3-dicarboxamide has a molecular weight of 190.20 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-ethenylbenzene-1,3-dicarboxamide is sourced from PubChem (CID 68671351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).