N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide

C23H21N3O3 — CID 2223178

IUPACN-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccc(NC(=O)c3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C23H21N3O3/c1-15-3-5-17(6-4-15)22(28)25-20-9-7-18(8-10-20)23(29)26-21-13-11-19(12-14-21)24-16(2)27/h3-14H,1-2H3,(H,24,27)(H,25,28)(H,26,29)
InChIKeySAYIOAVTUSCERO-UHFFFAOYSA-N
MW387.44 g/mol
LogP4.46
Rot. Bonds5

About N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide

N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide (PubChem CID 2223178) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide
PubChem CID2223178
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC NameN-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccc(NC(=O)c3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C23H21N3O3/c1-15-3-5-17(6-4-15)22(28)25-20-9-7-18(8-10-20)23(29)26-21-13-11-19(12-14-21)24-16(2)27/h3-14H,1-2H3,(H,24,27)(H,25,28)(H,26,29)
InChIKeySAYIOAVTUSCERO-UHFFFAOYSA-N
XLogP4.46
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 54.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylphenyl)-4-[2-[4-[(4-methylphenyl)carbamoyl]phenyl]hydrazinyl]benzamide
CID 139337158
N-(4-methylphenyl)acetamide
CID 7684
4-[[4-[(4-acetamidobenzoyl)amino]benzoyl]amino]benzoic acid
CID 155141284
4-methyl-N-[4-[[4-[(4-methylbenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 2330632
methanamine;N-(4-methylphenyl)acetamide
CID 142152295
4-N-(4-acetamidophenyl)benzene-1,4-dicarboxamide
CID 27648779
4-carbamothioyl-N-(4-methylphenyl)benzamide
CID 24707290
4-[(4-methylphenyl)carbamoylamino]-N-phenylbenzamide
CID 143832330
N-(4-methylphenyl)-4-(trifluoromethyl)benzamide
CID 599447
4-acetamido-N-[4-[(4-acetamidophenyl)diazenyl]phenyl]benzamide
CID 130360401
ethane;4-ethyl-N-(4-methylphenyl)benzamide
CID 143234775
N-[4-(bromomethyl)phenyl]-4-methylbenzamide
CID 113274673

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide?
The IUPAC name of N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide (CID 2223178) is N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide.
What is the SMILES notation for N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide?
The canonical SMILES for N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide is CC(=O)Nc1ccc(NC(=O)c2ccc(NC(=O)c3ccc(C)cc3)cc2)cc1.
What is the InChIKey of N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide?
The InChIKey is SAYIOAVTUSCERO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c1-15-3-5-17(6-4-15)22(28)25-20-9-7-18(8-10-20)23(29)26-21-13-11-19(12-14-21)24-16(2)27/h3-14H,1-2H3,(H,24,27)(H,25,28)(H,26,29).
What are the key properties of N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide?
N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide has a molecular weight of 387.44 g/mol, XLogP of 4.46, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide is sourced from PubChem (CID 2223178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).