2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide

C30H28N2O6 — CID 1119717

IUPAC2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
SMILESCOc1cc(-c2ccc(NC(=O)c3ccccc3OC)c(OC)c2)ccc1NC(=O)c1ccccc1OC
InChIInChI=1S/C30H28N2O6/c1-35-25-11-7-5-9-21(25)29(33)31-23-15-13-19(17-27(23)37-3)20-14-16-24(28(18-20)38-4)32-30(34)22-10-6-8-12-26(22)36-2/h5-18H,1-4H3,(H,31,33)(H,32,34)
InChIKeyNSMNQLZHPZBFIJ-UHFFFAOYSA-N
MW512.56 g/mol
LogP5.89
Rot. Bonds9

About 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide

2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide (PubChem CID 1119717) has the molecular formula C30H28N2O6 and a molecular weight of 512.56 g/mol. Its IUPAC name is 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
PubChem CID1119717
Molecular FormulaC30H28N2O6
Molecular Weight512.56 g/mol
Exact Mass512.19
IUPAC Name2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
SMILESCOc1cc(-c2ccc(NC(=O)c3ccccc3OC)c(OC)c2)ccc1NC(=O)c1ccccc1OC
InChIInChI=1S/C30H28N2O6/c1-35-25-11-7-5-9-21(25)29(33)31-23-15-13-19(17-27(23)37-3)20-14-16-24(28(18-20)38-4)32-30(34)22-10-6-8-12-26(22)36-2/h5-18H,1-4H3,(H,31,33)(H,32,34)
InChIKeyNSMNQLZHPZBFIJ-UHFFFAOYSA-N
XLogP5.89
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.56
LogP ≤ 55.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-hydroxy-5-phenylphenyl)-2-methoxybenzamide
CID 3265384
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
N-(2-acetamidophenyl)-2-methoxybenzamide
CID 113093661
N-[4-[(2-aminoacetyl)amino]-2-methoxyphenyl]-2-methoxybenzamide
CID 39184598
N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 814241
5-iodo-2-[(2-methoxybenzoyl)amino]benzoic acid
CID 45345783
N-(4-amino-2-hydroxyphenyl)-2-methoxybenzamide
CID 51063245
methyl 4-[(2-methoxybenzoyl)amino]-3-methylbenzoate
CID 36928114
2-methoxy-N-(2-prop-1-en-2-ylphenyl)benzamide
CID 175134678
N-[4-[4-[(3,5-dimethylbenzoyl)amino]-3-methoxyphenyl]-2-methoxyphenyl]-3,5-dimethylbenzamide
CID 4537878
N-(5-chloro-2-fluorophenyl)-2-methoxybenzamide
CID 8759235
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide?
The IUPAC name of 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide (CID 1119717) is 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide?
The canonical SMILES for 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide is COc1cc(-c2ccc(NC(=O)c3ccccc3OC)c(OC)c2)ccc1NC(=O)c1ccccc1OC.
What is the InChIKey of 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide?
The InChIKey is NSMNQLZHPZBFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28N2O6/c1-35-25-11-7-5-9-21(25)29(33)31-23-15-13-19(17-27(23)37-3)20-14-16-24(28(18-20)38-4)32-30(34)22-10-6-8-12-26(22)36-2/h5-18H,1-4H3,(H,31,33)(H,32,34).
What are the key properties of 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide?
2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide has a molecular weight of 512.56 g/mol, XLogP of 5.89, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide is sourced from PubChem (CID 1119717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).