2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide

C15H14ClIN2O — CID 11384038

IUPAC2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide
SMILESCCN(C(=O)c1cc(Cl)ccc1N)c1ccccc1I
InChIInChI=1S/C15H14ClIN2O/c1-2-19(14-6-4-3-5-12(14)17)15(20)11-9-10(16)7-8-13(11)18/h3-9H,2,18H2,1H3
InChIKeyXWHZZYSKXQPHRN-UHFFFAOYSA-N
MW400.65 g/mol
LogP4.19
Rot. Bonds3

About 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide

2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide (PubChem CID 11384038) has the molecular formula C15H14ClIN2O and a molecular weight of 400.65 g/mol. Its IUPAC name is 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide
PubChem CID11384038
Molecular FormulaC15H14ClIN2O
Molecular Weight400.65 g/mol
Exact Mass399.98
IUPAC Name2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide
SMILESCCN(C(=O)c1cc(Cl)ccc1N)c1ccccc1I
InChIInChI=1S/C15H14ClIN2O/c1-2-19(14-6-4-3-5-12(14)17)15(20)11-9-10(16)7-8-13(11)18/h3-9H,2,18H2,1H3
InChIKeyXWHZZYSKXQPHRN-UHFFFAOYSA-N
XLogP4.19
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.65
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminophenyl)-4-chloro-N-ethyl-2,5-difluorobenzamide
CID 82772425
2,4-dichloro-N-[(1,3-dioxoisoindol-2-yl)methyl]-N-(2-iodophenyl)benzamide
CID 124544627
N-(2-aminophenyl)-2-bromo-4-chloro-N-propylbenzamide
CID 107986331
2-amino-5-chloro-N-cyclopentyl-N-ethylbenzamide
CID 43540646
N-(2-aminophenyl)-2,5-dichloro-N-(2-hydroxyethyl)benzamide
CID 43547864
N-(2-aminophenyl)-4-bromo-N-ethyl-2-fluorobenzamide
CID 62101480
N-(4-aminophenyl)-5-chloro-N-ethyl-2-fluorobenzamide
CID 63230338
2-amino-5-chloro-N-(2-ethoxyethyl)-N-ethylbenzamide
CID 63696093
N-(2-aminophenyl)-3-bromo-4-chloro-N-ethylbenzamide
CID 107997593
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-methylbenzamide
CID 107733112
(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone
CID 18069
2-amino-4-chloro-N,N-diethylbenzamide
CID 16773722

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide?
The IUPAC name of 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide (CID 11384038) is 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide.
What is the SMILES notation for 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide?
The canonical SMILES for 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide is CCN(C(=O)c1cc(Cl)ccc1N)c1ccccc1I.
What is the InChIKey of 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide?
The InChIKey is XWHZZYSKXQPHRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClIN2O/c1-2-19(14-6-4-3-5-12(14)17)15(20)11-9-10(16)7-8-13(11)18/h3-9H,2,18H2,1H3.
What are the key properties of 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide?
2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide has a molecular weight of 400.65 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-ethyl-N-(2-iodophenyl)benzamide is sourced from PubChem (CID 11384038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).