N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide

C14H10Cl2N2O3 — CID 4048119

IUPACN-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1Cl
InChIInChI=1S/C14H10Cl2N2O3/c15-10-3-1-9(2-4-10)7-14(19)17-13-8-11(18(20)21)5-6-12(13)16/h1-6,8H,7H2,(H,17,19)
InChIKeyMKRDTQZIKHAJLT-UHFFFAOYSA-N
MW325.15 g/mol
LogP4.08
Rot. Bonds4

About N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide

N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide (PubChem CID 4048119) has the molecular formula C14H10Cl2N2O3 and a molecular weight of 325.15 g/mol. Its IUPAC name is N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide
PubChem CID4048119
Molecular FormulaC14H10Cl2N2O3
Molecular Weight325.15 g/mol
Exact Mass324.01
IUPAC NameN-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1Cl
InChIInChI=1S/C14H10Cl2N2O3/c15-10-3-1-9(2-4-10)7-14(19)17-13-8-11(18(20)21)5-6-12(13)16/h1-6,8H,7H2,(H,17,19)
InChIKeyMKRDTQZIKHAJLT-UHFFFAOYSA-N
XLogP4.08
TPSA72.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.15
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-chloro-5-nitrophenyl)-2-(4-methylphenyl)acetamide
CID 889214
2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 4639208
N-(2-chloro-5-nitrophenyl)-2-(4-phenylphenyl)acetamide
CID 92556751
N-(2-chloro-5-nitrophenyl)propanamide
CID 4280315
3-(2-chloro-5-nitroanilino)-3-oxopropanoic acid
CID 62231127
2-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 2892197
4-chloro-N-(2-chloro-5-nitrophenyl)benzamide
CID 720125
2-chloro-N-[(4-chlorophenyl)methyl]-5-nitroaniline
CID 43718811
N-(2-chloro-5-nitrophenyl)-2-(dimethylamino)acetamide
CID 11043415
N-(2-chloro-5-nitrophenyl)-4-hydroxybutanamide
CID 79200872
4-chloro-2-[[2-(4-nitrophenyl)acetyl]amino]benzoate
CID 7372821
[2-(2-chloro-5-nitroanilino)-2-oxoethyl]-trimethylazanium chloride
CID 11098862

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide?
The IUPAC name of N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide (CID 4048119) is N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide.
What is the SMILES notation for N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide?
The canonical SMILES for N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide is O=C(Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1Cl.
What is the InChIKey of N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide?
The InChIKey is MKRDTQZIKHAJLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2O3/c15-10-3-1-9(2-4-10)7-14(19)17-13-8-11(18(20)21)5-6-12(13)16/h1-6,8H,7H2,(H,17,19).
What are the key properties of N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide?
N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide has a molecular weight of 325.15 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide is sourced from PubChem (CID 4048119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).