5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide

C14H11Cl3N2O — CID 107624082

IUPAC5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide
SMILESCc1ccc(Cl)c(NC(=O)c2cc(N)cc(Cl)c2Cl)c1
InChIInChI=1S/C14H11Cl3N2O/c1-7-2-3-10(15)12(4-7)19-14(20)9-5-8(18)6-11(16)13(9)17/h2-6H,18H2,1H3,(H,19,20)
InChIKeyFRKRADSAWYPIHE-UHFFFAOYSA-N
MW329.61 g/mol
LogP4.79
Rot. Bonds2

About 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide

5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide (PubChem CID 107624082) has the molecular formula C14H11Cl3N2O and a molecular weight of 329.61 g/mol. Its IUPAC name is 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide.

Molecular Properties

Compound Name5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide
PubChem CID107624082
Molecular FormulaC14H11Cl3N2O
Molecular Weight329.61 g/mol
Exact Mass327.99
IUPAC Name5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide
SMILESCc1ccc(Cl)c(NC(=O)c2cc(N)cc(Cl)c2Cl)c1
InChIInChI=1S/C14H11Cl3N2O/c1-7-2-3-10(15)12(4-7)19-14(20)9-5-8(18)6-11(16)13(9)17/h2-6H,18H2,1H3,(H,19,20)
InChIKeyFRKRADSAWYPIHE-UHFFFAOYSA-N
XLogP4.79
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.61
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-amino-N-(2-bromo-5-methylphenyl)-2,3-dichlorobenzamide
CID 107185700
5-amino-2,3-dichloro-N-(5-fluoro-2-methylphenyl)benzamide
CID 107183212
5-amino-2,3-dichloro-N-(4-fluoro-2-methylphenyl)benzamide
CID 107183229
N-(2-chloro-5-methylphenyl)-2-hydroxy-4-methylbenzamide
CID 103769568
5-amino-2,3-dichloro-N-(2,5-difluoro-4-methylphenyl)benzamide
CID 107186123
N-(2-chloro-5-methylphenyl)-2-hydroxybenzamide
CID 103769569
4-amino-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 28967456
2-amino-N-(5-bromo-2-chlorophenyl)-5-methylbenzamide
CID 62908448
2-amino-N-(2-chloro-5-methylphenyl)-5-methoxybenzamide
CID 107624036
5-amino-2,3-dichloro-N-(2,3-difluorophenyl)benzamide
CID 107183805
5-amino-2,3-dichloro-N-(2-ethoxyphenyl)benzamide
CID 107183316
5-amino-N-(4-bromo-5-fluoro-2-methylphenyl)-2,3-dichlorobenzamide
CID 107185996

Frequently Asked Questions

What is the IUPAC name of 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide?
The IUPAC name of 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide (CID 107624082) is 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide.
What is the SMILES notation for 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide?
The canonical SMILES for 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide is Cc1ccc(Cl)c(NC(=O)c2cc(N)cc(Cl)c2Cl)c1.
What is the InChIKey of 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide?
The InChIKey is FRKRADSAWYPIHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl3N2O/c1-7-2-3-10(15)12(4-7)19-14(20)9-5-8(18)6-11(16)13(9)17/h2-6H,18H2,1H3,(H,19,20).
What are the key properties of 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide?
5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide has a molecular weight of 329.61 g/mol, XLogP of 4.79, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2,3-dichloro-N-(2-chloro-5-methylphenyl)benzamide is sourced from PubChem (CID 107624082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).