3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide

C22H19ClN2O4 — CID 46323153

IUPAC3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(Cl)c3)ccc2OC)cc1
InChIInChI=1S/C22H19ClN2O4/c1-28-18-9-6-14(7-10-18)21(26)25-19-13-17(8-11-20(19)29-2)24-22(27)15-4-3-5-16(23)12-15/h3-13H,1-2H3,(H,24,27)(H,25,26)
InChIKeyMCGXTQSGQGSCSZ-UHFFFAOYSA-N
MW410.86 g/mol
LogP4.86
Rot. Bonds6

About 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide

3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide (PubChem CID 46323153) has the molecular formula C22H19ClN2O4 and a molecular weight of 410.86 g/mol. Its IUPAC name is 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide
PubChem CID46323153
Molecular FormulaC22H19ClN2O4
Molecular Weight410.86 g/mol
Exact Mass410.10
IUPAC Name3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(Cl)c3)ccc2OC)cc1
InChIInChI=1S/C22H19ClN2O4/c1-28-18-9-6-14(7-10-18)21(26)25-19-13-17(8-11-20(19)29-2)24-22(27)15-4-3-5-16(23)12-15/h3-13H,1-2H3,(H,24,27)(H,25,26)
InChIKeyMCGXTQSGQGSCSZ-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-[4-(5-chloro-2-methoxyanilino)phenyl]-4-methoxybenzamide
CID 112987245
3-fluoro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]-4-methylbenzamide
CID 46323189
N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,4-dimethoxybenzamide
CID 17314016
N-[4-[(3-chlorobenzoyl)amino]phenyl]-2,6-dimethoxybenzamide
CID 22775702
4-methoxy-N-[2-methoxy-5-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]benzamide
CID 46323188
3-chloro-4-methoxy-N-(4-methoxyphenyl)benzamide
CID 44871411
4-[[(2R)-1-(5-chloro-2-methoxyanilino)-1-oxopropan-2-yl]amino]-N-(4-methoxyphenyl)benzamide
CID 25355176
3-chloro-N-[3-(difluoromethoxy)-4-methoxyphenyl]benzamide
CID 38082386
4-methoxy-N-[2-methoxy-5-[(2-phenoxyacetyl)amino]phenyl]benzamide
CID 46323186
3-chloro-N-[4-[2-(2,5-dimethoxyanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]benzamide
CID 21168508
4-methoxy-N-(2-methoxy-5-methylphenyl)benzamide
CID 2302629
2-[(3-chlorobenzoyl)amino]-4,5-dimethoxybenzoic acid
CID 16777026

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide?
The IUPAC name of 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide (CID 46323153) is 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide.
What is the SMILES notation for 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide?
The canonical SMILES for 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide is COc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(Cl)c3)ccc2OC)cc1.
What is the InChIKey of 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide?
The InChIKey is MCGXTQSGQGSCSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClN2O4/c1-28-18-9-6-14(7-10-18)21(26)25-19-13-17(8-11-20(19)29-2)24-22(27)15-4-3-5-16(23)12-15/h3-13H,1-2H3,(H,24,27)(H,25,26).
What are the key properties of 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide?
3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide 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 3-chloro-N-[4-methoxy-3-[(4-methoxybenzoyl)amino]phenyl]benzamide is sourced from PubChem (CID 46323153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).