2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide

C14H10BrCl2FN2O — CID 81146753

IUPAC2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide
SMILESNC(=O)C(Nc1ccc(Cl)c(Br)c1)c1ccc(F)c(Cl)c1
InChIInChI=1S/C14H10BrCl2FN2O/c15-9-6-8(2-3-10(9)16)20-13(14(19)21)7-1-4-12(18)11(17)5-7/h1-6,13,20H,(H2,19,21)
InChIKeyNUDCJYFQWRMMAI-UHFFFAOYSA-N
MW392.06 g/mol
LogP4.53
Rot. Bonds4

About 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide

2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide (PubChem CID 81146753) has the molecular formula C14H10BrCl2FN2O and a molecular weight of 392.06 g/mol. Its IUPAC name is 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide
PubChem CID81146753
Molecular FormulaC14H10BrCl2FN2O
Molecular Weight392.06 g/mol
Exact Mass389.93
IUPAC Name2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide
SMILESNC(=O)C(Nc1ccc(Cl)c(Br)c1)c1ccc(F)c(Cl)c1
InChIInChI=1S/C14H10BrCl2FN2O/c15-9-6-8(2-3-10(9)16)20-13(14(19)21)7-1-4-12(18)11(17)5-7/h1-6,13,20H,(H2,19,21)
InChIKeyNUDCJYFQWRMMAI-UHFFFAOYSA-N
XLogP4.53
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.06
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromo-4-chloroanilino)-2-(3,5-difluorophenyl)acetamide
CID 106528880
2-(3-bromo-4-chloroanilino)-2-(4-chloro-2-fluorophenyl)acetamide
CID 114843602
2-(3-chloro-4-fluorophenyl)-2-(4-methoxyanilino)acetamide
CID 81146886
2-(3-chloroanilino)-2-(3,4-dichlorophenyl)acetamide
CID 61005060
2-(3-bromo-4-chloroanilino)-2-(3-chloro-5-fluorophenyl)acetic acid
CID 114453619
methyl 2-(3-bromo-4-chlorophenyl)-2-(4-fluoroanilino)acetate
CID 83233258
2-(3-bromoanilino)-2-(4-chlorophenyl)acetamide
CID 54891742
2-(4-bromo-3-fluorophenyl)-2-(3-fluoroanilino)acetamide
CID 81437584
2-(3-bromo-4-chlorophenyl)-2-(2-methoxyethylamino)acetamide
CID 83229954
2-(4-bromo-3-methylphenyl)-2-(4-fluoroanilino)acetamide
CID 66480971
(2S)-2-(3-chloro-4-hydroxyphenyl)-2-(3-fluoro-5-methylanilino)acetamide
CID 97055135
2-(3,5-dichlorophenyl)-2-(4-fluoroanilino)acetamide
CID 61005627

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide?
The IUPAC name of 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide (CID 81146753) is 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide?
The canonical SMILES for 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide is NC(=O)C(Nc1ccc(Cl)c(Br)c1)c1ccc(F)c(Cl)c1.
What is the InChIKey of 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide?
The InChIKey is NUDCJYFQWRMMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrCl2FN2O/c15-9-6-8(2-3-10(9)16)20-13(14(19)21)7-1-4-12(18)11(17)5-7/h1-6,13,20H,(H2,19,21).
What are the key properties of 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide?
2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide has a molecular weight of 392.06 g/mol, XLogP of 4.53, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-4-chloroanilino)-2-(3-chloro-4-fluorophenyl)acetamide is sourced from PubChem (CID 81146753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).