3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide

C18H19N3O3 — CID 134037398

IUPAC3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2cccc(C(=O)N(C)C)c2)cc1
InChIInChI=1S/C18H19N3O3/c1-12(22)19-15-9-7-13(8-10-15)17(23)20-16-6-4-5-14(11-16)18(24)21(2)3/h4-11H,1-3H3,(H,19,22)(H,20,23)
InChIKeyALXXKZUJBZAQGR-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.60
Rot. Bonds4

About 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide

3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide (PubChem CID 134037398) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide
PubChem CID134037398
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2cccc(C(=O)N(C)C)c2)cc1
InChIInChI=1S/C18H19N3O3/c1-12(22)19-15-9-7-13(8-10-15)17(23)20-16-6-4-5-14(11-16)18(24)21(2)3/h4-11H,1-3H3,(H,19,22)(H,20,23)
InChIKeyALXXKZUJBZAQGR-UHFFFAOYSA-N
XLogP2.60
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-3-[(4-phenylbenzoyl)amino]benzamide
CID 17231735
3-[[(E)-3-(4-acetamidophenyl)prop-2-enoyl]amino]-N,N-dimethylbenzamide
CID 32852031
3-[[4-(difluoromethylsulfanyl)benzoyl]amino]-N,N-dimethylbenzamide
CID 51339145
N,N-dimethyl-3-[[4-(methylsulfonylmethyl)benzoyl]amino]benzamide
CID 32626914
4-acetamido-N-(3-hydroxyphenyl)benzamide
CID 110463964
N-[3-(dimethylcarbamoyl)phenyl]-3-iodo-4-methylbenzamide
CID 17231812
N-[3-(dimethylcarbamoyl)phenyl]-3-fluoro-4-methylbenzamide
CID 30379250
3-[(4-acetamidobenzoyl)amino]-4-chloro-N,N-dimethylbenzamide
CID 38957858
3-[[4-(tert-butylsulfamoyl)benzoyl]amino]-N,N-dimethylbenzamide
CID 32627137
N-[3-(dimethylcarbamoyl)phenyl]-1H-pyrazole-4-carboxamide
CID 60786152
3-[(4-acetamidobenzoyl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 46513546
N-[3-(dimethylcarbamoyl)phenyl]-3,5-dinitrobenzamide
CID 17231768

Frequently Asked Questions

What is the IUPAC name of 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide?
The IUPAC name of 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide (CID 134037398) is 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide.
What is the SMILES notation for 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide?
The canonical SMILES for 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide is CC(=O)Nc1ccc(C(=O)Nc2cccc(C(=O)N(C)C)c2)cc1.
What is the InChIKey of 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide?
The InChIKey is ALXXKZUJBZAQGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-12(22)19-15-9-7-13(8-10-15)17(23)20-16-6-4-5-14(11-16)18(24)21(2)3/h4-11H,1-3H3,(H,19,22)(H,20,23).
What are the key properties of 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide?
3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide has a molecular weight of 325.37 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-acetamidobenzoyl)amino]-N,N-dimethylbenzamide is sourced from PubChem (CID 134037398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).