2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide

C14H11BrClFN2O — CID 62914693

IUPAC2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide
SMILESO=C(CNc1cc(Br)ccc1Cl)Nc1cccc(F)c1
InChIInChI=1S/C14H11BrClFN2O/c15-9-4-5-12(16)13(6-9)18-8-14(20)19-11-3-1-2-10(17)7-11/h1-7,18H,8H2,(H,19,20)
InChIKeyIJQJVAFJKBOJLV-UHFFFAOYSA-N
MW357.61 g/mol
LogP4.29
Rot. Bonds4

About 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide

2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide (PubChem CID 62914693) has the molecular formula C14H11BrClFN2O and a molecular weight of 357.61 g/mol. Its IUPAC name is 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide
PubChem CID62914693
Molecular FormulaC14H11BrClFN2O
Molecular Weight357.61 g/mol
Exact Mass355.97
IUPAC Name2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide
SMILESO=C(CNc1cc(Br)ccc1Cl)Nc1cccc(F)c1
InChIInChI=1S/C14H11BrClFN2O/c15-9-4-5-12(16)13(6-9)18-8-14(20)19-11-3-1-2-10(17)7-11/h1-7,18H,8H2,(H,19,20)
InChIKeyIJQJVAFJKBOJLV-UHFFFAOYSA-N
XLogP4.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.61
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluorophenyl)-2-(2,4,5-trichloroanilino)acetamide
CID 29046314
2-(5-bromo-2-methoxyanilino)-N-(3-fluorophenyl)acetamide
CID 61061796
2-(5-bromo-2-chloroanilino)-N-(4-chlorophenyl)acetamide
CID 63492462
2-(2-bromo-4-chloroanilino)-N-(3-fluorophenyl)acetamide
CID 81271498
N-(3-bromophenyl)-2-(2,4,5-trichloroanilino)acetamide
CID 28515380
2-(4-chloro-2-methylanilino)-N-(3-fluorophenyl)acetamide
CID 26507132
2-(2-bromo-4-methylanilino)-N-(3-fluorophenyl)acetamide
CID 42070161
2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide
CID 9099614
2-(2-chloro-6-fluoroanilino)-N-(3-fluorophenyl)acetamide
CID 104530695
2-(2-chloro-4,6-dimethylanilino)-N-(3-fluorophenyl)acetamide
CID 42125202
3-(4-bromo-2-methylanilino)-N-(3-fluorophenyl)propanamide
CID 109042029
2-[4-chloro-2-(trifluoromethyl)anilino]-N-(3-fluorophenyl)acetamide
CID 109010763

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide (CID 62914693) is 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide is O=C(CNc1cc(Br)ccc1Cl)Nc1cccc(F)c1.
What is the InChIKey of 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide?
The InChIKey is IJQJVAFJKBOJLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClFN2O/c15-9-4-5-12(16)13(6-9)18-8-14(20)19-11-3-1-2-10(17)7-11/h1-7,18H,8H2,(H,19,20).
What are the key properties of 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide?
2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide has a molecular weight of 357.61 g/mol, XLogP of 4.29, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-chloroanilino)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 62914693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).