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

C23H23N3O2 — CID 54838219

IUPACN-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide
SMILESCN(C(=O)CNc1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C23H23N3O2/c1-25(20-9-5-3-6-10-20)22(27)17-24-19-15-13-18(14-16-19)23(28)26(2)21-11-7-4-8-12-21/h3-16,24H,17H2,1-2H3
InChIKeyYAXSGPPOPBUJHB-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.04
Rot. Bonds6

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

N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide (PubChem CID 54838219) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide.

Molecular Properties

Compound NameN-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide
PubChem CID54838219
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC NameN-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide
SMILESCN(C(=O)CNc1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C23H23N3O2/c1-25(20-9-5-3-6-10-20)22(27)17-24-19-15-13-18(14-16-19)23(28)26(2)21-11-7-4-8-12-21/h3-16,24H,17H2,1-2H3
InChIKeyYAXSGPPOPBUJHB-UHFFFAOYSA-N
XLogP4.04
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-acetylanilino)-N-methyl-N-phenylacetamide
CID 42996589
4-[[2-(N-methylanilino)-2-oxoethyl]amino]benzamide
CID 51224881
N-(3-methoxypropyl)-4-[[2-(N-methylanilino)-2-oxoethyl]amino]benzamide
CID 54835535
4-[[2-(4-iodoanilino)-2-oxoethyl]amino]-N-methyl-N-phenylbenzamide
CID 54838604
N-methyl-2-(naphthalen-2-ylamino)-N-phenylacetamide
CID 26417147
4-[[2-(azepan-1-yl)-2-oxoethyl]amino]-N-methyl-N-phenylbenzamide
CID 54838444
N-methyl-4-[[2-(naphthalen-2-ylamino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 54838200
N-methyl-4-[[2-[4-(2-methylpropanoylamino)anilino]acetyl]amino]-N-phenylbenzamide
CID 54833224
4-acetamido-N-methyl-N-phenylbenzamide
CID 669468
N-[2-(N-methylanilino)-2-oxoethyl]benzamide
CID 12674158
N-methyl-2-[4-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide
CID 54824242
2-(3-chloroanilino)-N-methyl-N-phenylacetamide
CID 39373771

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide?
The IUPAC name of N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide (CID 54838219) is N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide.
What is the SMILES notation for N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide?
The canonical SMILES for N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide is CN(C(=O)CNc1ccc(C(=O)N(C)c2ccccc2)cc1)c1ccccc1.
What is the InChIKey of N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide?
The InChIKey is YAXSGPPOPBUJHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-25(20-9-5-3-6-10-20)22(27)17-24-19-15-13-18(14-16-19)23(28)26(2)21-11-7-4-8-12-21/h3-16,24H,17H2,1-2H3.
What are the key properties of N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide?
N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide has a molecular weight of 373.46 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[[2-(N-methylanilino)-2-oxoethyl]amino]-N-phenylbenzamide is sourced from PubChem (CID 54838219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).