N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide

C14H11ClF2N2O — CID 47336969

IUPACN-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide
SMILESO=C(CNc1cccc(F)c1F)Nc1cccc(Cl)c1
InChIInChI=1S/C14H11ClF2N2O/c15-9-3-1-4-10(7-9)19-13(20)8-18-12-6-2-5-11(16)14(12)17/h1-7,18H,8H2,(H,19,20)
InChIKeyUDVFIRFZPKAVEF-UHFFFAOYSA-N
MW296.70 g/mol
LogP3.67
Rot. Bonds4

About N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide

N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide (PubChem CID 47336969) has the molecular formula C14H11ClF2N2O and a molecular weight of 296.70 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide
PubChem CID47336969
Molecular FormulaC14H11ClF2N2O
Molecular Weight296.70 g/mol
Exact Mass296.05
IUPAC NameN-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide
SMILESO=C(CNc1cccc(F)c1F)Nc1cccc(Cl)c1
InChIInChI=1S/C14H11ClF2N2O/c15-9-3-1-4-10(7-9)19-13(20)8-18-12-6-2-5-11(16)14(12)17/h1-7,18H,8H2,(H,19,20)
InChIKeyUDVFIRFZPKAVEF-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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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide (CID 47336969) is N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide is O=C(CNc1cccc(F)c1F)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide?
The InChIKey is UDVFIRFZPKAVEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF2N2O/c15-9-3-1-4-10(7-9)19-13(20)8-18-12-6-2-5-11(16)14(12)17/h1-7,18H,8H2,(H,19,20).
What are the key properties of N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide?
N-(3-chlorophenyl)-2-(2,3-difluoroanilino)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 N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide is sourced from PubChem (CID 47336969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).