3-benzamido-N,4-dimethylbenzamide

C16H16N2O2 — CID 17226324

IUPAC3-benzamido-N,4-dimethylbenzamide
SMILESCNC(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C16H16N2O2/c1-11-8-9-13(15(19)17-2)10-14(11)18-16(20)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChIKeyXHTFSYIGTGHZRN-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.61
Rot. Bonds3

About 3-benzamido-N,4-dimethylbenzamide

3-benzamido-N,4-dimethylbenzamide (PubChem CID 17226324) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 3-benzamido-N,4-dimethylbenzamide.

Molecular Properties

Compound Name3-benzamido-N,4-dimethylbenzamide
PubChem CID17226324
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name3-benzamido-N,4-dimethylbenzamide
SMILESCNC(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C16H16N2O2/c1-11-8-9-13(15(19)17-2)10-14(11)18-16(20)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChIKeyXHTFSYIGTGHZRN-UHFFFAOYSA-N
XLogP2.61
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-benzamido-N-(2-cyanophenyl)-4-methylbenzamide
CID 17226453
5-bromo-N-[2-methyl-5-(methylcarbamoyl)phenyl]thiophene-3-carboxamide
CID 39134325
3-benzamido-N-(2,3-dichlorophenyl)-4-methylbenzamide
CID 17226451
3-benzamido-N-(2-benzoyl-4-chlorophenyl)-4-methylbenzamide
CID 17226391
6-methyl-N-[2-methyl-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 46439271
3-benzamido-4-methyl-N-[4-(propanoylamino)phenyl]benzamide
CID 55788298
3-benzamido-N-[2-(tert-butylcarbamoyl)phenyl]-4-methylbenzamide
CID 17226566
3-benzamido-4-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 46411335
3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide
CID 75392218
(2S)-2-[(3-benzamido-4-methylbenzoyl)amino]-3-methylbutanoic acid
CID 119360446
3-benzamido-4-methyl-N-pentylbenzamide
CID 17226355
N,4-dimethyl-3-[[2-[(2-phenylacetyl)amino]acetyl]amino]benzamide
CID 43073786

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N,4-dimethylbenzamide?
The IUPAC name of 3-benzamido-N,4-dimethylbenzamide (CID 17226324) is 3-benzamido-N,4-dimethylbenzamide.
What is the SMILES notation for 3-benzamido-N,4-dimethylbenzamide?
The canonical SMILES for 3-benzamido-N,4-dimethylbenzamide is CNC(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1.
What is the InChIKey of 3-benzamido-N,4-dimethylbenzamide?
The InChIKey is XHTFSYIGTGHZRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-11-8-9-13(15(19)17-2)10-14(11)18-16(20)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,17,19)(H,18,20).
What are the key properties of 3-benzamido-N,4-dimethylbenzamide?
3-benzamido-N,4-dimethylbenzamide has a molecular weight of 268.32 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N,4-dimethylbenzamide is sourced from PubChem (CID 17226324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).