2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide

C11H6ClF2NO2 — CID 106685284

IUPAC2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccoc1Cl
InChIInChI=1S/C11H6ClF2NO2/c12-10-7(3-4-17-10)11(16)15-9-2-1-6(13)5-8(9)14/h1-5H,(H,15,16)
InChIKeyXJENIWMTQRFGJI-UHFFFAOYSA-N
MW257.62 g/mol
LogP3.46
Rot. Bonds2

About 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide

2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide (PubChem CID 106685284) has the molecular formula C11H6ClF2NO2 and a molecular weight of 257.62 g/mol. Its IUPAC name is 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide
PubChem CID106685284
Molecular FormulaC11H6ClF2NO2
Molecular Weight257.62 g/mol
Exact Mass257.01
IUPAC Name2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccoc1Cl
InChIInChI=1S/C11H6ClF2NO2/c12-10-7(3-4-17-10)11(16)15-9-2-1-6(13)5-8(9)14/h1-5H,(H,15,16)
InChIKeyXJENIWMTQRFGJI-UHFFFAOYSA-N
XLogP3.46
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.62
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide (CID 106685284) is 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide is O=C(Nc1ccc(F)cc1F)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide?
The InChIKey is XJENIWMTQRFGJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF2NO2/c12-10-7(3-4-17-10)11(16)15-9-2-1-6(13)5-8(9)14/h1-5H,(H,15,16).
What are the key properties of 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide?
2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide has a molecular weight of 257.62 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide is sourced from PubChem (CID 106685284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).