N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide

C23H22N2O2 — CID 55339888

IUPACN-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide
SMILESCc1ccc(NC(=O)CN(C)C(=O)c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C23H22N2O2/c1-17-12-14-19(15-13-17)24-22(26)16-25(2)23(27)21-11-7-6-10-20(21)18-8-4-3-5-9-18/h3-15H,16H2,1-2H3,(H,24,26)
InChIKeyLMHFCMRTGNBHSF-UHFFFAOYSA-N
MW358.44 g/mol
LogP4.37
Rot. Bonds5

About N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide

N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide (PubChem CID 55339888) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide
PubChem CID55339888
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC NameN-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide
SMILESCc1ccc(NC(=O)CN(C)C(=O)c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C23H22N2O2/c1-17-12-14-19(15-13-17)24-22(26)16-25(2)23(27)21-11-7-6-10-20(21)18-8-4-3-5-9-18/h3-15H,16H2,1-2H3,(H,24,26)
InChIKeyLMHFCMRTGNBHSF-UHFFFAOYSA-N
XLogP4.37
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-phenylbenzamide
CID 9494059
2-(difluoromethoxy)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 42052918
N,3-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-oxo-2-phenylchromene-8-carboxamide
CID 26192057
N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-nitrobenzamide
CID 26863291
[2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl] 4-phenylbenzoate
CID 2520530
2-hydroxy-N,3,4-trimethyl-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 87011131
N-(2-anilino-2-oxoethyl)-N,3-dimethyl-6-(4-methylphenyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55638797
2-[(4-methoxybenzoyl)amino]-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 38008073
5-(2-fluorophenyl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]thiophene-2-carboxamide
CID 55605253
N-[4-(ethylamino)phenyl]-2-(4-methylphenyl)benzamide
CID 141052756
2-hydroxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide
CID 39122596
N,3-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]furan-2-carboxamide
CID 38005582

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide?
The IUPAC name of N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide (CID 55339888) is N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide.
What is the SMILES notation for N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide?
The canonical SMILES for N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide is Cc1ccc(NC(=O)CN(C)C(=O)c2ccccc2-c2ccccc2)cc1.
What is the InChIKey of N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide?
The InChIKey is LMHFCMRTGNBHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-17-12-14-19(15-13-17)24-22(26)16-25(2)23(27)21-11-7-6-10-20(21)18-8-4-3-5-9-18/h3-15H,16H2,1-2H3,(H,24,26).
What are the key properties of N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide?
N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide has a molecular weight of 358.44 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylbenzamide is sourced from PubChem (CID 55339888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).