4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide

C14H12Cl2N2O3 — CID 102695314

IUPAC4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cc(Cl)c(N)c(Cl)c2)c(O)c1
InChIInChI=1S/C14H12Cl2N2O3/c1-21-8-2-3-11(12(19)6-8)18-14(20)7-4-9(15)13(17)10(16)5-7/h2-6,19H,17H2,1H3,(H,18,20)
InChIKeyHUSRSUYMQOAKHR-UHFFFAOYSA-N
MW327.17 g/mol
LogP3.54
Rot. Bonds3

About 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide

4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide (PubChem CID 102695314) has the molecular formula C14H12Cl2N2O3 and a molecular weight of 327.17 g/mol. Its IUPAC name is 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide
PubChem CID102695314
Molecular FormulaC14H12Cl2N2O3
Molecular Weight327.17 g/mol
Exact Mass326.02
IUPAC Name4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cc(Cl)c(N)c(Cl)c2)c(O)c1
InChIInChI=1S/C14H12Cl2N2O3/c1-21-8-2-3-11(12(19)6-8)18-14(20)7-4-9(15)13(17)10(16)5-7/h2-6,19H,17H2,1H3,(H,18,20)
InChIKeyHUSRSUYMQOAKHR-UHFFFAOYSA-N
XLogP3.54
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.17
LogP ≤ 53.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

4-amino-3,5-dichloro-N-(2-chloro-5-methoxyphenyl)benzamide
CID 82810855
N-(2-amino-4-methoxyphenyl)-3,4-dichlorobenzamide
CID 16777237
N-(2,4-dihydroxyphenyl)-4-methoxybenzamide
CID 141075428
4-amino-3,5-dichloro-N-(2-methoxyphenyl)benzamide
CID 82792962
N-(2-chloro-4-hydroxyphenyl)-4-methoxybenzamide;N-(2-chloro-4-methoxyphenyl)-4-methoxybenzamide
CID 86605166
4-amino-3,5-dichloro-N-(2-chlorophenyl)benzamide
CID 82832841
4-amino-3,5-dichloro-N-(2-methoxy-5-methylphenyl)benzamide
CID 82812467
4-[(2-chloro-4-methoxybenzoyl)amino]-3-hydroxybenzoic acid
CID 58230869
4-amino-3,5-dichloro-N-(2-chloro-4-methylphenyl)benzamide
CID 82832914
2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide
CID 102695337
2-amino-6-chloro-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide
CID 62872287
N-(5-amino-2-chlorophenyl)-2-hydroxy-4-methoxybenzamide
CID 43548769

Frequently Asked Questions

What is the IUPAC name of 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide?
The IUPAC name of 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide (CID 102695314) is 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide.
What is the SMILES notation for 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide?
The canonical SMILES for 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide is COc1ccc(NC(=O)c2cc(Cl)c(N)c(Cl)c2)c(O)c1.
What is the InChIKey of 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide?
The InChIKey is HUSRSUYMQOAKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O3/c1-21-8-2-3-11(12(19)6-8)18-14(20)7-4-9(15)13(17)10(16)5-7/h2-6,19H,17H2,1H3,(H,18,20).
What are the key properties of 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide?
4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide has a molecular weight of 327.17 g/mol, XLogP of 3.54, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3,5-dichloro-N-(2-hydroxy-4-methoxyphenyl)benzamide is sourced from PubChem (CID 102695314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).