2-(2,3-difluoroanilino)propanamide

C9H10F2N2O — CID 61075391

IUPAC2-(2,3-difluoroanilino)propanamide
SMILESCC(Nc1cccc(F)c1F)C(N)=O
InChIInChI=1S/C9H10F2N2O/c1-5(9(12)14)13-7-4-2-3-6(10)8(7)11/h2-5,13H,1H3,(H2,12,14)
InChIKeyMFJWKIYQILEMIW-UHFFFAOYSA-N
MW200.19 g/mol
LogP1.25
Rot. Bonds3

About 2-(2,3-difluoroanilino)propanamide

2-(2,3-difluoroanilino)propanamide (PubChem CID 61075391) has the molecular formula C9H10F2N2O and a molecular weight of 200.19 g/mol. Its IUPAC name is 2-(2,3-difluoroanilino)propanamide.

Molecular Properties

Compound Name2-(2,3-difluoroanilino)propanamide
PubChem CID61075391
Molecular FormulaC9H10F2N2O
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name2-(2,3-difluoroanilino)propanamide
SMILESCC(Nc1cccc(F)c1F)C(N)=O
InChIInChI=1S/C9H10F2N2O/c1-5(9(12)14)13-7-4-2-3-6(10)8(7)11/h2-5,13H,1H3,(H2,12,14)
InChIKeyMFJWKIYQILEMIW-UHFFFAOYSA-N
XLogP1.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluoroanilino)propanamide?
The IUPAC name of 2-(2,3-difluoroanilino)propanamide (CID 61075391) is 2-(2,3-difluoroanilino)propanamide.
What is the SMILES notation for 2-(2,3-difluoroanilino)propanamide?
The canonical SMILES for 2-(2,3-difluoroanilino)propanamide is CC(Nc1cccc(F)c1F)C(N)=O.
What is the InChIKey of 2-(2,3-difluoroanilino)propanamide?
The InChIKey is MFJWKIYQILEMIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O/c1-5(9(12)14)13-7-4-2-3-6(10)8(7)11/h2-5,13H,1H3,(H2,12,14).
What are the key properties of 2-(2,3-difluoroanilino)propanamide?
2-(2,3-difluoroanilino)propanamide has a molecular weight of 200.19 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluoroanilino)propanamide is sourced from PubChem (CID 61075391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).