N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide

C14H10ClFN2O3 — CID 3319160

IUPACN-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1
InChIInChI=1S/C14H10ClFN2O3/c15-12-6-5-11(8-13(12)18(20)21)17-14(19)7-9-1-3-10(16)4-2-9/h1-6,8H,7H2,(H,17,19)
InChIKeyCRLLMTQMSNLJJH-UHFFFAOYSA-N
MW308.70 g/mol
LogP3.57
Rot. Bonds4

About N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide

N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide (PubChem CID 3319160) has the molecular formula C14H10ClFN2O3 and a molecular weight of 308.70 g/mol. Its IUPAC name is N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
PubChem CID3319160
Molecular FormulaC14H10ClFN2O3
Molecular Weight308.70 g/mol
Exact Mass308.04
IUPAC NameN-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1
InChIInChI=1S/C14H10ClFN2O3/c15-12-6-5-11(8-13(12)18(20)21)17-14(19)7-9-1-3-10(16)4-2-9/h1-6,8H,7H2,(H,17,19)
InChIKeyCRLLMTQMSNLJJH-UHFFFAOYSA-N
XLogP3.57
TPSA72.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.70
LogP ≤ 53.57
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-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
CID 797948
N,N'-bis(4-chloro-3-nitrophenyl)butanediamide
CID 3339507
N-(4-chloro-3-nitrophenyl)-4-[(2-phenylacetyl)amino]benzamide
CID 17119387
N,N'-bis(4-chloro-3-nitrophenyl)decanediamide
CID 17080083
N-[3-chloro-4-(2-nitroacetyl)phenyl]-2-(4-fluorophenyl)acetamide
CID 18541397
methyl 2-[4-[2-(4-chloro-3-nitroanilino)-2-oxoethoxy]phenyl]acetate
CID 7695259
N-(4-chloro-3-nitrophenyl)-2-[[5-[(4-fluorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
CID 27067731
N-[(Z)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-2-(4-fluorophenyl)acetamide
CID 7428724
4-amino-N-(4-chloro-3-nitrophenyl)butanamide
CID 43708466
N-(4-chloro-3-nitrophenyl)-3-(2-chlorophenyl)propanamide
CID 17178923
N-(2-chloro-4-fluorophenyl)-2-(4-chloro-3-nitroanilino)acetamide
CID 26438778
1-(4-chloro-3-nitrophenyl)-3-[(E)-2-(4-fluorophenyl)ethenyl]urea
CID 108908008

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide (CID 3319160) is N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide is O=C(Cc1ccc(F)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1.
What is the InChIKey of N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The InChIKey is CRLLMTQMSNLJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFN2O3/c15-12-6-5-11(8-13(12)18(20)21)17-14(19)7-9-1-3-10(16)4-2-9/h1-6,8H,7H2,(H,17,19).
What are the key properties of N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide has a molecular weight of 308.70 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 3319160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).