2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide

C22H20N2O6 — CID 23249025

IUPAC2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(OC)cc3O)cc2)c(O)c1
InChIInChI=1S/C22H20N2O6/c1-29-15-7-9-17(19(25)11-15)21(27)23-13-3-5-14(6-4-13)24-22(28)18-10-8-16(30-2)12-20(18)26/h3-12,25-26H,1-2H3,(H,23,27)(H,24,28)
InChIKeyBDGHQDIWIKQWIV-UHFFFAOYSA-N
MW408.41 g/mol
LogP3.62
Rot. Bonds6

About 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide

2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide (PubChem CID 23249025) has the molecular formula C22H20N2O6 and a molecular weight of 408.41 g/mol. Its IUPAC name is 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide.

Molecular Properties

Compound Name2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
PubChem CID23249025
Molecular FormulaC22H20N2O6
Molecular Weight408.41 g/mol
Exact Mass408.13
IUPAC Name2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(OC)cc3O)cc2)c(O)c1
InChIInChI=1S/C22H20N2O6/c1-29-15-7-9-17(19(25)11-15)21(27)23-13-3-5-14(6-4-13)24-22(28)18-10-8-16(30-2)12-20(18)26/h3-12,25-26H,1-2H3,(H,23,27)(H,24,28)
InChIKeyBDGHQDIWIKQWIV-UHFFFAOYSA-N
XLogP3.62
TPSA117.12 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.41
LogP ≤ 53.62
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

2-hydroxy-4-methoxy-N-(4-methylsulfonylphenyl)benzamide
CID 155988762
2-hydroxy-4-methoxy-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]benzamide
CID 38401851
2-hydroxy-N-[4-(2-hydroxyethyl)phenyl]-4-methoxybenzamide
CID 61221954
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303
N-(3-amino-4-bromophenyl)-2-hydroxy-4-methoxybenzamide
CID 79768120
N-(3-chlorophenyl)-2-hydroxy-4-methoxybenzamide
CID 5274047
N-(4-hydroxyphenyl)-2,5-dimethoxybenzamide
CID 48824493
N-[3-(chloromethyl)phenyl]-2-hydroxy-4-methoxybenzamide
CID 114293188
N-(3-carbamothioylphenyl)-2-hydroxy-4-methoxybenzamide
CID 29032119
N-(6-chloro-5-methyl-3-pyridinyl)-2-hydroxy-4-methoxybenzamide
CID 103746246
2-hydroxy-4-methoxy-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38204734
2,5-dimethoxy-N-(4-methoxyphenyl)benzamide
CID 8574615

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide?
The IUPAC name of 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide (CID 23249025) is 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide.
What is the SMILES notation for 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide?
The canonical SMILES for 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(OC)cc3O)cc2)c(O)c1.
What is the InChIKey of 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide?
The InChIKey is BDGHQDIWIKQWIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O6/c1-29-15-7-9-17(19(25)11-15)21(27)23-13-3-5-14(6-4-13)24-22(28)18-10-8-16(30-2)12-20(18)26/h3-12,25-26H,1-2H3,(H,23,27)(H,24,28).
What are the key properties of 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide?
2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide has a molecular weight of 408.41 g/mol, XLogP of 3.62, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide is sourced from PubChem (CID 23249025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).