3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide

C22H20N2O3 — CID 5082074

IUPAC3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide
SMILESCOc1cc(C)ccc1NC(=O)c1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C22H20N2O3/c1-15-11-12-19(20(13-15)27-2)24-22(26)17-9-6-10-18(14-17)23-21(25)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,23,25)(H,24,26)
InChIKeyZSXJTKNJNNITCI-UHFFFAOYSA-N
MW360.41 g/mol
LogP4.51
Rot. Bonds5

About 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide

3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide (PubChem CID 5082074) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide.

Molecular Properties

Compound Name3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide
PubChem CID5082074
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide
SMILESCOc1cc(C)ccc1NC(=O)c1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C22H20N2O3/c1-15-11-12-19(20(13-15)27-2)24-22(26)17-9-6-10-18(14-17)23-21(25)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,23,25)(H,24,26)
InChIKeyZSXJTKNJNNITCI-UHFFFAOYSA-N
XLogP4.51
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-bromobenzoyl)amino]-N-(2-methoxyphenyl)benzamide
CID 52644751
2-[[3-[(2-methoxybenzoyl)amino]benzoyl]amino]benzoic acid
CID 17341336
3-anilino-N-(2-methoxyphenyl)benzamide
CID 3501279
N-(2,4-dimethoxyphenyl)-3-methylbenzamide
CID 710450
N-(4-benzamido-2,5-dimethoxyphenyl)benzamide
CID 1053126
3-iodo-4-methoxy-N-[3-[(3-methylphenyl)carbamoyl]phenyl]benzamide
CID 26164546
3-acetamido-N-(4-amino-2-methoxyphenyl)benzamide
CID 28867873
3-acetamido-N-(2,4-dimethoxy-3-methylphenyl)benzamide
CID 110792976
ethyl N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]carbamate
CID 17415342
N-(4-benzamido-3-methylphenyl)-3-methoxybenzamide
CID 1365764
N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide
CID 52843930
1-N-(2,4-dimethylphenyl)-3-N-(2-methoxy-5-methylphenyl)benzene-1,3-dicarboxamide
CID 109057155

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide?
The IUPAC name of 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide (CID 5082074) is 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide.
What is the SMILES notation for 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide?
The canonical SMILES for 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide is COc1cc(C)ccc1NC(=O)c1cccc(NC(=O)c2ccccc2)c1.
What is the InChIKey of 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide?
The InChIKey is ZSXJTKNJNNITCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-15-11-12-19(20(13-15)27-2)24-22(26)17-9-6-10-18(14-17)23-21(25)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide?
3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide has a molecular weight of 360.41 g/mol, XLogP of 4.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide is sourced from PubChem (CID 5082074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).