5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide

C17H10ClF2NO2 — CID 18208546

IUPAC5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H10ClF2NO2/c18-11-3-1-10(2-4-11)15-7-8-16(23-15)17(22)21-12-5-6-13(19)14(20)9-12/h1-9H,(H,21,22)
InChIKeySYEJQQXDUAYWME-UHFFFAOYSA-N
MW333.72 g/mol
LogP5.13
Rot. Bonds3

About 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide

5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide (PubChem CID 18208546) has the molecular formula C17H10ClF2NO2 and a molecular weight of 333.72 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide
PubChem CID18208546
Molecular FormulaC17H10ClF2NO2
Molecular Weight333.72 g/mol
Exact Mass333.04
IUPAC Name5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H10ClF2NO2/c18-11-3-1-10(2-4-11)15-7-8-16(23-15)17(22)21-12-5-6-13(19)14(20)9-12/h1-9H,(H,21,22)
InChIKeySYEJQQXDUAYWME-UHFFFAOYSA-N
XLogP5.13
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.72
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,5-bis(4-chlorophenyl)furan-2-carboxamide
CID 781867
N-(4-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 18871483
5-(4-chlorophenyl)-N-(2-methyl-1,3-dioxoisoindol-5-yl)furan-2-carboxamide
CID 1227268
N-(4-chlorophenyl)-5-(3,4-dimethylphenyl)furan-2-carboxamide
CID 4031207
N-(3-amino-4-fluorophenyl)-5-(4-bromophenyl)furan-2-carboxamide
CID 91689995
5-(4-chlorophenyl)-N-(2-methyl-4-pyridinyl)furan-2-carboxamide
CID 24776776
5-(4-chlorophenyl)-N-(2,3,4-trifluorophenyl)furan-2-carboxamide
CID 43029737
5-(4-chlorophenyl)-N-(2-fluoro-4-iodophenyl)furan-2-carboxamide
CID 2232193
N-[4-(acetylcarbamothioylamino)phenyl]-5-(4-chlorophenyl)furan-2-carboxamide
CID 5230073
N-[4-(butanoylamino)phenyl]-5-(4-chlorophenyl)furan-2-carboxamide
CID 5343907
5-(4-chlorophenyl)-N-quinolin-6-ylfuran-2-carboxamide;hydrochloride
CID 24776664
5-(4-chlorophenyl)-N-(2,4,5-trichlorophenyl)furan-2-carboxamide
CID 23995235

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide (CID 18208546) is 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide is O=C(Nc1ccc(F)c(F)c1)c1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide?
The InChIKey is SYEJQQXDUAYWME-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10ClF2NO2/c18-11-3-1-10(2-4-11)15-7-8-16(23-15)17(22)21-12-5-6-13(19)14(20)9-12/h1-9H,(H,21,22).
What are the key properties of 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide?
5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide has a molecular weight of 333.72 g/mol, XLogP of 5.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-(3,4-difluorophenyl)furan-2-carboxamide is sourced from PubChem (CID 18208546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).