N-methyl-N-[3-(N-methylanilino)phenyl]benzamide

C21H20N2O — CID 129066255

IUPACN-methyl-N-[3-(N-methylanilino)phenyl]benzamide
SMILESCN(C(=O)c1ccccc1)c1cccc(N(C)c2ccccc2)c1
InChIInChI=1S/C21H20N2O/c1-22(18-12-7-4-8-13-18)19-14-9-15-20(16-19)23(2)21(24)17-10-5-3-6-11-17/h3-16H,1-2H3
InChIKeyYNZNTCLAMGJSJJ-UHFFFAOYSA-N
MW316.40 g/mol
LogP4.73
Rot. Bonds4

About N-methyl-N-[3-(N-methylanilino)phenyl]benzamide

N-methyl-N-[3-(N-methylanilino)phenyl]benzamide (PubChem CID 129066255) has the molecular formula C21H20N2O and a molecular weight of 316.40 g/mol. Its IUPAC name is N-methyl-N-[3-(N-methylanilino)phenyl]benzamide.

Molecular Properties

Compound NameN-methyl-N-[3-(N-methylanilino)phenyl]benzamide
PubChem CID129066255
Molecular FormulaC21H20N2O
Molecular Weight316.40 g/mol
Exact Mass316.16
IUPAC NameN-methyl-N-[3-(N-methylanilino)phenyl]benzamide
SMILESCN(C(=O)c1ccccc1)c1cccc(N(C)c2ccccc2)c1
InChIInChI=1S/C21H20N2O/c1-22(18-12-7-4-8-13-18)19-14-9-15-20(16-19)23(2)21(24)17-10-5-3-6-11-17/h3-16H,1-2H3
InChIKeyYNZNTCLAMGJSJJ-UHFFFAOYSA-N
XLogP4.73
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;N-methyl-N-[3-(N-methylanilino)phenyl]benzamide;N-methyl-3-(N-methylanilino)-N-phenylbenzamide
CID 161374433
N-[3-[benzoyl(methyl)amino]phenyl]-N-methylbenzamide
CID 59642334
N-(3-ethylphenyl)-N-methylbenzamide
CID 90124245
N-(3-carbamothioylphenyl)-N-methylbenzamide
CID 62969755
N-[3-(N'-hydroxycarbamimidoyl)phenyl]-N-methylbenzamide
CID 76932856
benzoic acid;N-methyl-N-phenylaniline
CID 158055475
4-[(3-methoxyphenyl)-methylcarbamoyl]benzoic acid
CID 62003468
4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
CID 23508483
3-benzoyl-N-(3-fluorophenyl)-N-methylbenzamide
CID 18545673
4-amino-N-methyl-N-phenylbenzamide
CID 4306081
3-(N,4-dimethylanilino)benzoic acid
CID 102822798
3-[(3-cyanophenyl)-methylcarbamoyl]benzoic acid
CID 62981166

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[3-(N-methylanilino)phenyl]benzamide?
The IUPAC name of N-methyl-N-[3-(N-methylanilino)phenyl]benzamide (CID 129066255) is N-methyl-N-[3-(N-methylanilino)phenyl]benzamide.
What is the SMILES notation for N-methyl-N-[3-(N-methylanilino)phenyl]benzamide?
The canonical SMILES for N-methyl-N-[3-(N-methylanilino)phenyl]benzamide is CN(C(=O)c1ccccc1)c1cccc(N(C)c2ccccc2)c1.
What is the InChIKey of N-methyl-N-[3-(N-methylanilino)phenyl]benzamide?
The InChIKey is YNZNTCLAMGJSJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O/c1-22(18-12-7-4-8-13-18)19-14-9-15-20(16-19)23(2)21(24)17-10-5-3-6-11-17/h3-16H,1-2H3.
What are the key properties of N-methyl-N-[3-(N-methylanilino)phenyl]benzamide?
N-methyl-N-[3-(N-methylanilino)phenyl]benzamide has a molecular weight of 316.40 g/mol, XLogP of 4.73, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[3-(N-methylanilino)phenyl]benzamide is sourced from PubChem (CID 129066255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).