3-benzamido-N-(2,4-dimethoxyphenyl)benzamide

C22H20N2O4 — CID 1309237

IUPAC3-benzamido-N-(2,4-dimethoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)c(OC)c1
InChIInChI=1S/C22H20N2O4/c1-27-18-11-12-19(20(14-18)28-2)24-22(26)16-9-6-10-17(13-16)23-21(25)15-7-4-3-5-8-15/h3-14H,1-2H3,(H,23,25)(H,24,26)
InChIKeyCNQHDJTXDVROKT-UHFFFAOYSA-N
MW376.41 g/mol
LogP4.21
Rot. Bonds6

About 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide

3-benzamido-N-(2,4-dimethoxyphenyl)benzamide (PubChem CID 1309237) has the molecular formula C22H20N2O4 and a molecular weight of 376.41 g/mol. Its IUPAC name is 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide.

Molecular Properties

Compound Name3-benzamido-N-(2,4-dimethoxyphenyl)benzamide
PubChem CID1309237
Molecular FormulaC22H20N2O4
Molecular Weight376.41 g/mol
Exact Mass376.14
IUPAC Name3-benzamido-N-(2,4-dimethoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)c(OC)c1
InChIInChI=1S/C22H20N2O4/c1-27-18-11-12-19(20(14-18)28-2)24-22(26)16-9-6-10-17(13-16)23-21(25)15-7-4-3-5-8-15/h3-14H,1-2H3,(H,23,25)(H,24,26)
InChIKeyCNQHDJTXDVROKT-UHFFFAOYSA-N
XLogP4.21
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Benzenepropanamide, N-(2-methoxyphenyl)-beta-oxo-
CID 7079
3-Amino-4-methoxybenzanilide
CID 8426
N-(2,4-dimethoxyphenyl)-4-methylbenzamide
CID 710605
N-(2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide
CID 2321450
4-amino-N-(2-methoxyphenyl)benzamide
CID 2317363
4-methoxy-~{N}-oxidanyl-3-[(4-phenylphenyl)carbonylamino]benzamide
CID 127045675
N-(2-methoxyphenyl)-2-[[2-[(2-methoxyphenyl)carbamoyl]phenyl]diselanyl]benzamide
CID 13673587
N~1~,N~6~-bis(2,4-dimethoxyphenyl)hexanediamide
CID 4601418
3,4,5-Trimethoxy-N-(2-methoxyphenyl)benzamide
CID 199280
2-Iodo-2'-methoxybenzanilide
CID 615893
3-(2,4-Dimethoxyanilino)-5-phenylcyclohex-2-en-1-one
CID 2859221
4-methoxy-~{N}-oxidanyl-3-(2-phenylethanoylamino)benzamide
CID 127047413

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide?
The IUPAC name of 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide (CID 1309237) is 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide.
What is the SMILES notation for 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide?
The canonical SMILES for 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide is COc1ccc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)c(OC)c1.
What is the InChIKey of 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide?
The InChIKey is CNQHDJTXDVROKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O4/c1-27-18-11-12-19(20(14-18)28-2)24-22(26)16-9-6-10-17(13-16)23-21(25)15-7-4-3-5-8-15/h3-14H,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide?
3-benzamido-N-(2,4-dimethoxyphenyl)benzamide has a molecular weight of 376.41 g/mol, XLogP of 4.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N-(2,4-dimethoxyphenyl)benzamide is sourced from PubChem (CID 1309237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).