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

C14H11ClF2N2O — CID 9099614

IUPAC2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide
SMILESO=C(CNc1ccc(F)c(Cl)c1)Nc1cccc(F)c1
InChIInChI=1S/C14H11ClF2N2O/c15-12-7-10(4-5-13(12)17)18-8-14(20)19-11-3-1-2-9(16)6-11/h1-7,18H,8H2,(H,19,20)
InChIKeyVKOKZQPAORYCMY-UHFFFAOYSA-N
MW296.70 g/mol
LogP3.67
Rot. Bonds4

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

2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide (PubChem CID 9099614) has the molecular formula C14H11ClF2N2O and a molecular weight of 296.70 g/mol. Its IUPAC name is 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide
PubChem CID9099614
Molecular FormulaC14H11ClF2N2O
Molecular Weight296.70 g/mol
Exact Mass296.05
IUPAC Name2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide
SMILESO=C(CNc1ccc(F)c(Cl)c1)Nc1cccc(F)c1
InChIInChI=1S/C14H11ClF2N2O/c15-12-7-10(4-5-13(12)17)18-8-14(20)19-11-3-1-2-9(16)6-11/h1-7,18H,8H2,(H,19,20)
InChIKeyVKOKZQPAORYCMY-UHFFFAOYSA-N
XLogP3.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.70
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-acetylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 9084520
N-[3-[[2-(3-chloro-4-fluoroanilino)acetyl]amino]phenyl]-2,2-dimethylpropanamide
CID 54818383
1-(3-chloro-4-fluorophenyl)-3-(3-fluorophenyl)urea
CID 108893983
2-[3-chloro-4-(difluoromethoxy)anilino]-N-(3-fluorophenyl)acetamide
CID 9103360
3-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 31418295
3-[[2-(3-chloro-4-fluoroanilino)acetyl]amino]-N,N-dimethylbenzamide
CID 29454051
2-(2-chloro-6-fluoroanilino)-N-(3-fluorophenyl)acetamide
CID 104530695
N-(3,4-dimethylphenyl)-2-(3-fluoroanilino)acetamide
CID 9098883
2-(4-fluoro-3-methoxyanilino)-N-(3-fluorophenyl)acetamide
CID 114839513
2-(4-chloro-2-methylanilino)-N-(3-fluorophenyl)acetamide
CID 26507132
N-(3-chloro-4-fluorophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54815845
N-(3-fluorophenyl)-2-(2,4,5-trichloroanilino)acetamide
CID 29046314

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide (CID 9099614) is 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide is O=C(CNc1ccc(F)c(Cl)c1)Nc1cccc(F)c1.
What is the InChIKey of 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide?
The InChIKey is VKOKZQPAORYCMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF2N2O/c15-12-7-10(4-5-13(12)17)18-8-14(20)19-11-3-1-2-9(16)6-11/h1-7,18H,8H2,(H,19,20).
What are the key properties of 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide?
2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide has a molecular weight of 296.70 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-fluoroanilino)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 9099614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).