N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide

C22H19ClN2O4 — CID 68786791

IUPACN-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)cc(NC(=O)c3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C22H19ClN2O4/c1-28-19-7-3-14(4-8-19)21(26)24-17-11-16(23)12-18(13-17)25-22(27)15-5-9-20(29-2)10-6-15/h3-13H,1-2H3,(H,24,26)(H,25,27)
InChIKeyWYLACFXJJSQCDI-UHFFFAOYSA-N
MW410.86 g/mol
LogP4.86
Rot. Bonds6

About N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide

N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide (PubChem CID 68786791) has the molecular formula C22H19ClN2O4 and a molecular weight of 410.86 g/mol. Its IUPAC name is N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
PubChem CID68786791
Molecular FormulaC22H19ClN2O4
Molecular Weight410.86 g/mol
Exact Mass410.10
IUPAC NameN-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)cc(NC(=O)c3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C22H19ClN2O4/c1-28-19-7-3-14(4-8-19)21(26)24-17-11-16(23)12-18(13-17)25-22(27)15-5-9-20(29-2)10-6-15/h3-13H,1-2H3,(H,24,26)(H,25,27)
InChIKeyWYLACFXJJSQCDI-UHFFFAOYSA-N
XLogP4.86
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.86
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
CID 1254136
N-(4-chlorophenyl)-4-(4-methoxyphenoxy)benzamide
CID 16651140
4-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 4198373
N-(3,5-dimethylphenyl)-4-(4-methoxyphenoxy)benzamide
CID 16651159
methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate
CID 7733773
3-chloro-4-methoxy-N-(4-methoxyphenyl)benzamide
CID 44871411
N-[4-(5-chloro-2-methoxyanilino)phenyl]-4-methoxybenzamide
CID 112987245
N-(4-bromophenyl)-4-[(4-methoxybenzoyl)amino]benzamide
CID 2214535
4-hydrazinyl-N-(4-methoxyphenyl)benzamide
CID 62237684
N-(3-amino-5-fluorophenyl)-4-methoxybenzamide
CID 107333930
N-(2-bromo-5-chlorophenyl)-4-methoxybenzamide
CID 81271849
N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide
CID 27844181

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide?
The IUPAC name of N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide (CID 68786791) is N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide.
What is the SMILES notation for N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide?
The canonical SMILES for N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2cc(Cl)cc(NC(=O)c3ccc(OC)cc3)c2)cc1.
What is the InChIKey of N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide?
The InChIKey is WYLACFXJJSQCDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClN2O4/c1-28-19-7-3-14(4-8-19)21(26)24-17-11-16(23)12-18(13-17)25-22(27)15-5-9-20(29-2)10-6-15/h3-13H,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide?
N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide has a molecular weight of 410.86 g/mol, XLogP of 4.86, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide is sourced from PubChem (CID 68786791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).