N-(4-ethenylbenzoyl)-2-methoxybenzamide

C17H15NO3 — CID 139609261

IUPACN-(4-ethenylbenzoyl)-2-methoxybenzamide
SMILESC=Cc1ccc(C(=O)NC(=O)c2ccccc2OC)cc1
InChIInChI=1S/C17H15NO3/c1-3-12-8-10-13(11-9-12)16(19)18-17(20)14-6-4-5-7-15(14)21-2/h3-11H,1H2,2H3,(H,18,19,20)
InChIKeyXCWUZNMHOJSUOL-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.91
Rot. Bonds4

About N-(4-ethenylbenzoyl)-2-methoxybenzamide

N-(4-ethenylbenzoyl)-2-methoxybenzamide (PubChem CID 139609261) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-(4-ethenylbenzoyl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(4-ethenylbenzoyl)-2-methoxybenzamide
PubChem CID139609261
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC NameN-(4-ethenylbenzoyl)-2-methoxybenzamide
SMILESC=Cc1ccc(C(=O)NC(=O)c2ccccc2OC)cc1
InChIInChI=1S/C17H15NO3/c1-3-12-8-10-13(11-9-12)16(19)18-17(20)14-6-4-5-7-15(14)21-2/h3-11H,1H2,2H3,(H,18,19,20)
InChIKeyXCWUZNMHOJSUOL-UHFFFAOYSA-N
XLogP2.91
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(Z)-but-2-ene;2-methoxy-N-methylbenzamide
CID 144547446
2-methoxy-N-prop-2-enylbenzamide
CID 4063222
2-methoxy-N-[[(4-methylbenzoyl)amino]carbamothioyl]benzamide
CID 4980698
prop-2-enyl (Z)-2-[(2-methoxybenzoyl)amino]-3-(4-methoxyphenyl)prop-2-enoate
CID 2247969
[4-(2,6-dimethoxyphenyl)phenyl]-[2-(4-ethenylphenyl)phenyl]methanone
CID 56850780
methyl 4-[[(2-methoxybenzoyl)hydrazinylidene]methyl]benzoate
CID 3669406
2-methoxybenzohydrazide
CID 24051
N-[4-(hydrazinecarbonyl)phenyl]-2-methoxybenzamide
CID 139030098
4-[(Z)-2-carboxy-2-(2-methoxyphenyl)ethenyl]benzoic acid
CID 83955775
2-methoxy-N-[(Z)-1-(4-methylphenyl)ethylideneamino]benzamide
CID 6152790
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 4-hydroxybenzoate
CID 2624849

Frequently Asked Questions

What is the IUPAC name of N-(4-ethenylbenzoyl)-2-methoxybenzamide?
The IUPAC name of N-(4-ethenylbenzoyl)-2-methoxybenzamide (CID 139609261) is N-(4-ethenylbenzoyl)-2-methoxybenzamide.
What is the SMILES notation for N-(4-ethenylbenzoyl)-2-methoxybenzamide?
The canonical SMILES for N-(4-ethenylbenzoyl)-2-methoxybenzamide is C=Cc1ccc(C(=O)NC(=O)c2ccccc2OC)cc1.
What is the InChIKey of N-(4-ethenylbenzoyl)-2-methoxybenzamide?
The InChIKey is XCWUZNMHOJSUOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-3-12-8-10-13(11-9-12)16(19)18-17(20)14-6-4-5-7-15(14)21-2/h3-11H,1H2,2H3,(H,18,19,20).
What are the key properties of N-(4-ethenylbenzoyl)-2-methoxybenzamide?
N-(4-ethenylbenzoyl)-2-methoxybenzamide has a molecular weight of 281.31 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethenylbenzoyl)-2-methoxybenzamide is sourced from PubChem (CID 139609261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).