2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide

C14H10Cl2N2O4 — CID 112771738

IUPAC2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)Nc1cc([N+](=O)[O-])ccc1O
InChIInChI=1S/C14H10Cl2N2O4/c15-9-2-1-8(11(16)6-9)5-14(20)17-12-7-10(18(21)22)3-4-13(12)19/h1-4,6-7,19H,5H2,(H,17,20)
InChIKeyQMXUGHBQIIKOGJ-UHFFFAOYSA-N
MW341.15 g/mol
LogP3.79
Rot. Bonds4

About 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide

2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide (PubChem CID 112771738) has the molecular formula C14H10Cl2N2O4 and a molecular weight of 341.15 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
PubChem CID112771738
Molecular FormulaC14H10Cl2N2O4
Molecular Weight341.15 g/mol
Exact Mass340.00
IUPAC Name2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)Nc1cc([N+](=O)[O-])ccc1O
InChIInChI=1S/C14H10Cl2N2O4/c15-9-2-1-8(11(16)6-9)5-14(20)17-12-7-10(18(21)22)3-4-13(12)19/h1-4,6-7,19H,5H2,(H,17,20)
InChIKeyQMXUGHBQIIKOGJ-UHFFFAOYSA-N
XLogP3.79
TPSA92.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.15
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 4639208
2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide
CID 9268719
2-(2-fluorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 103602366
N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide
CID 4048119
3-amino-N-(2-hydroxy-5-nitrophenyl)propanamide
CID 107744574
2-bromo-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 4089912
2-(4-chloro-2-methylphenoxy)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 17342420
N-[(2,4-dichlorophenyl)methyl]-2-(4-nitrophenyl)acetamide
CID 9218215
2-(3-bromophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 103894337
N-(2-hydroxy-5-nitrophenyl)-2-(3-methylphenyl)acetamide
CID 103863285
2-(2-chlorophenyl)sulfanyl-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 112771769
5-(2-hydroxy-5-nitroanilino)-5-oxopentanoic acid
CID 3546109

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide (CID 112771738) is 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide is O=C(Cc1ccc(Cl)cc1Cl)Nc1cc([N+](=O)[O-])ccc1O.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide?
The InChIKey is QMXUGHBQIIKOGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2O4/c15-9-2-1-8(11(16)6-9)5-14(20)17-12-7-10(18(21)22)3-4-13(12)19/h1-4,6-7,19H,5H2,(H,17,20).
What are the key properties of 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide?
2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide has a molecular weight of 341.15 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide is sourced from PubChem (CID 112771738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).