4-formamido-N-prop-2-enylbenzamide

C11H12N2O2 — CID 64992358

IUPAC4-formamido-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccc(NC=O)cc1
InChIInChI=1S/C11H12N2O2/c1-2-7-12-11(15)9-3-5-10(6-4-9)13-8-14/h2-6,8H,1,7H2,(H,12,15)(H,13,14)
InChIKeyCXCUWRGYSRNYRG-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.17
Rot. Bonds5

About 4-formamido-N-prop-2-enylbenzamide

4-formamido-N-prop-2-enylbenzamide (PubChem CID 64992358) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 4-formamido-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name4-formamido-N-prop-2-enylbenzamide
PubChem CID64992358
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name4-formamido-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccc(NC=O)cc1
InChIInChI=1S/C11H12N2O2/c1-2-7-12-11(15)9-3-5-10(6-4-9)13-8-14/h2-6,8H,1,7H2,(H,12,15)(H,13,14)
InChIKeyCXCUWRGYSRNYRG-UHFFFAOYSA-N
XLogP1.17
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-prop-2-enyl-4-[4-(prop-2-enylcarbamoyl)phenyl]benzamide
CID 3714314
4-hydrazinyl-N-prop-2-enylbenzamide
CID 138742315
4-N-(4-acetamidophenyl)-1-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043595
4-(125I)iodo-N-prop-2-enyl(125I)benzamide
CID 118652264
N-prop-2-enyl-4-(sulfamoylamino)benzamide
CID 112573721
N-prop-2-enyl-4-[(2,2,2-trifluoroacetyl)amino]benzamide
CID 62726927
4-[(2,2-difluoroacetyl)amino]-N-prop-2-enylbenzamide
CID 103515175
N-prop-2-enyl-4-(propylcarbamoylamino)benzamide
CID 47265151
4-[(2-amino-2-methylpropanoyl)amino]-N-prop-2-enylbenzamide
CID 61267193
4-(3,3-dimethylbutylamino)-N-prop-2-enylbenzamide
CID 55156001
4-[(4-aminocyclohexyl)amino]-N-prop-2-enylbenzamide
CID 79730453
4-[[3-(ethylamino)-2-methylpropanoyl]amino]-N-prop-2-enylbenzamide
CID 62853093

Frequently Asked Questions

What is the IUPAC name of 4-formamido-N-prop-2-enylbenzamide?
The IUPAC name of 4-formamido-N-prop-2-enylbenzamide (CID 64992358) is 4-formamido-N-prop-2-enylbenzamide.
What is the SMILES notation for 4-formamido-N-prop-2-enylbenzamide?
The canonical SMILES for 4-formamido-N-prop-2-enylbenzamide is C=CCNC(=O)c1ccc(NC=O)cc1.
What is the InChIKey of 4-formamido-N-prop-2-enylbenzamide?
The InChIKey is CXCUWRGYSRNYRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-2-7-12-11(15)9-3-5-10(6-4-9)13-8-14/h2-6,8H,1,7H2,(H,12,15)(H,13,14).
What are the key properties of 4-formamido-N-prop-2-enylbenzamide?
4-formamido-N-prop-2-enylbenzamide has a molecular weight of 204.23 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-formamido-N-prop-2-enylbenzamide is sourced from PubChem (CID 64992358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).