N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide

C18H12F2N2O3 — CID 46400813

IUPACN-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide
SMILESNC(=O)c1cc(NC(=O)c2ccc(-c3ccccc3F)o2)ccc1F
InChIInChI=1S/C18H12F2N2O3/c19-13-4-2-1-3-11(13)15-7-8-16(25-15)18(24)22-10-5-6-14(20)12(9-10)17(21)23/h1-9H,(H2,21,23)(H,22,24)
InChIKeyYMDIINMQIGILFO-UHFFFAOYSA-N
MW342.30 g/mol
LogP3.58
Rot. Bonds4

About N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide

N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide (PubChem CID 46400813) has the molecular formula C18H12F2N2O3 and a molecular weight of 342.30 g/mol. Its IUPAC name is N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide
PubChem CID46400813
Molecular FormulaC18H12F2N2O3
Molecular Weight342.30 g/mol
Exact Mass342.08
IUPAC NameN-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide
SMILESNC(=O)c1cc(NC(=O)c2ccc(-c3ccccc3F)o2)ccc1F
InChIInChI=1S/C18H12F2N2O3/c19-13-4-2-1-3-11(13)15-7-8-16(25-15)18(24)22-10-5-6-14(20)12(9-10)17(21)23/h1-9H,(H2,21,23)(H,22,24)
InChIKeyYMDIINMQIGILFO-UHFFFAOYSA-N
XLogP3.58
TPSA85.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.30
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dimethylphenyl)-5-(2-fluorophenyl)furan-2-carboxamide
CID 3872686
N-(4-acetamidophenyl)-5-(2-fluorophenyl)furan-2-carboxamide
CID 1251716
N-(3-carbamoyl-4-fluorophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 39213699
N-[4-(difluoromethoxy)phenyl]-5-(2-fluorophenyl)furan-2-carboxamide
CID 9427796
N-(4-chloro-2-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide
CID 9404808
5-(2-fluorophenyl)-N-(2,3,4-trifluorophenyl)furan-2-carboxamide
CID 17472963
N-(5-chloro-2-hydroxyphenyl)-5-(2-fluorophenyl)furan-2-carboxamide
CID 134014960
5-(2-fluorophenyl)-N-[4-(methylsulfamoyl)phenyl]furan-2-carboxamide
CID 9429381
N-(5-acetamido-2-methoxyphenyl)-5-(2-fluorophenyl)furan-2-carboxamide
CID 17478266
1-(3-chlorophenyl)-3-[[5-(2-fluorophenyl)furan-2-carbonyl]amino]thiourea
CID 9428356
N-[4-[(2,5-dioxopyrrolidin-1-yl)methyl]phenyl]-5-(2-fluorophenyl)furan-2-carboxamide
CID 46570175
5-(2-fluorophenyl)-N-quinolin-2-ylfuran-2-carboxamide
CID 47008040

Frequently Asked Questions

What is the IUPAC name of N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide?
The IUPAC name of N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide (CID 46400813) is N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide.
What is the SMILES notation for N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide?
The canonical SMILES for N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide is NC(=O)c1cc(NC(=O)c2ccc(-c3ccccc3F)o2)ccc1F.
What is the InChIKey of N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide?
The InChIKey is YMDIINMQIGILFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F2N2O3/c19-13-4-2-1-3-11(13)15-7-8-16(25-15)18(24)22-10-5-6-14(20)12(9-10)17(21)23/h1-9H,(H2,21,23)(H,22,24).
What are the key properties of N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide?
N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide has a molecular weight of 342.30 g/mol, XLogP of 3.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbamoyl-4-fluorophenyl)-5-(2-fluorophenyl)furan-2-carboxamide is sourced from PubChem (CID 46400813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).