4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide

C8H8Cl2N2O2 — CID 130956892

IUPAC4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide
SMILESCN(O)C(=O)c1cc(Cl)c(N)c(Cl)c1
InChIInChI=1S/C8H8Cl2N2O2/c1-12(14)8(13)4-2-5(9)7(11)6(10)3-4/h2-3,14H,11H2,1H3
InChIKeySXKDLSPDJZUZBE-UHFFFAOYSA-N
MW235.07 g/mol
LogP2.04
Rot. Bonds1

About 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide

4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide (PubChem CID 130956892) has the molecular formula C8H8Cl2N2O2 and a molecular weight of 235.07 g/mol. Its IUPAC name is 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide.

Molecular Properties

Compound Name4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide
PubChem CID130956892
Molecular FormulaC8H8Cl2N2O2
Molecular Weight235.07 g/mol
Exact Mass234.00
IUPAC Name4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide
SMILESCN(O)C(=O)c1cc(Cl)c(N)c(Cl)c1
InChIInChI=1S/C8H8Cl2N2O2/c1-12(14)8(13)4-2-5(9)7(11)6(10)3-4/h2-3,14H,11H2,1H3
InChIKeySXKDLSPDJZUZBE-UHFFFAOYSA-N
XLogP2.04
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.07
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-amino-3-chloro-N-hydroxy-N-methylbenzamide
CID 131124028
4-amino-3,5-dichloro-N-(2-hydroxyethyl)-N-methylbenzamide
CID 82832639
4-amino-3,5-dichloro-N-methyl-N-pentan-3-ylbenzamide
CID 82832777
4-amino-3,5-dichloro-N-[2-(dimethylamino)-2-oxoethyl]-N-methylbenzamide
CID 82833484
4-amino-3,5-dichloro-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 82833409
4-amino-3,5-dichloro-N-[(4-fluorophenyl)methyl]-N-methylbenzamide
CID 82781126
4-amino-3,5-dichloro-N,N-bis(cyanomethyl)benzamide
CID 82833195
4-amino-3,5-dichloro-N-methyl-N-(4-methylsulfanylbutan-2-yl)benzamide
CID 115869170
4-amino-3,5-dichloro-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 82833511
(4-amino-3,5-dichlorophenyl)-(3,5-dimethylphenyl)methanone
CID 116609737
4-amino-3,5-dichloro-N-[2-[ethyl(methyl)amino]-2-oxoethyl]benzamide
CID 104931694
4-amino-3,5-dichloro-N-[4-(dimethylamino)butyl]benzamide
CID 82833147

Frequently Asked Questions

What is the IUPAC name of 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide?
The IUPAC name of 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide (CID 130956892) is 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide.
What is the SMILES notation for 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide?
The canonical SMILES for 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide is CN(O)C(=O)c1cc(Cl)c(N)c(Cl)c1.
What is the InChIKey of 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide?
The InChIKey is SXKDLSPDJZUZBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Cl2N2O2/c1-12(14)8(13)4-2-5(9)7(11)6(10)3-4/h2-3,14H,11H2,1H3.
What are the key properties of 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide?
4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide has a molecular weight of 235.07 g/mol, XLogP of 2.04, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3,5-dichloro-N-hydroxy-N-methylbenzamide is sourced from PubChem (CID 130956892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).