N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide

C20H16F2N2O3 — CID 55821382

IUPACN-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCC(NC(=O)c1cccc(NC(=O)c2ccco2)c1)c1ccc(F)cc1F
InChIInChI=1S/C20H16F2N2O3/c1-12(16-8-7-14(21)11-17(16)22)23-19(25)13-4-2-5-15(10-13)24-20(26)18-6-3-9-27-18/h2-12H,1H3,(H,23,25)(H,24,26)
InChIKeyVDWPGEIQYSKJKO-UHFFFAOYSA-N
MW370.36 g/mol
LogP4.30
Rot. Bonds5

About N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide

N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide (PubChem CID 55821382) has the molecular formula C20H16F2N2O3 and a molecular weight of 370.36 g/mol. Its IUPAC name is N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
PubChem CID55821382
Molecular FormulaC20H16F2N2O3
Molecular Weight370.36 g/mol
Exact Mass370.11
IUPAC NameN-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCC(NC(=O)c1cccc(NC(=O)c2ccco2)c1)c1ccc(F)cc1F
InChIInChI=1S/C20H16F2N2O3/c1-12(16-8-7-14(21)11-17(16)22)23-19(25)13-4-2-5-15(10-13)24-20(26)18-6-3-9-27-18/h2-12H,1H3,(H,23,25)(H,24,26)
InChIKeyVDWPGEIQYSKJKO-UHFFFAOYSA-N
XLogP4.30
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.36
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[1-(2-chlorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 55822141
N-[2-[[2-[[(1S)-1-(2,4-difluorophenyl)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 9225176
N-[3-[(3-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 27244358
(2R)-2-[[3-(furan-2-carbonylamino)benzoyl]amino]-4-methylpentanoic acid
CID 119363496
N-[1-(2,4-difluorophenyl)ethyl]-3-methoxybenzamide
CID 42907068
N-[3-[(4-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 51179863
N-[3-(2-hydroxypropylcarbamoyl)phenyl]furan-2-carboxamide
CID 78897732
N-[1-(2,4-difluorophenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 24635649
4-acetamido-N-[(1R)-1-(2,4-difluorophenyl)ethyl]benzamide
CID 26172289
N-[4-[1-(2-chlorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 51205981
N-[1-(2,4-difluorophenyl)ethyl]-3-[(1,3-dioxoisoindol-2-yl)methyl]benzamide
CID 112763749
N-[(2R)-1-oxo-1-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]anilino]propan-2-yl]furan-2-carboxamide
CID 30341754

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide (CID 55821382) is N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide is CC(NC(=O)c1cccc(NC(=O)c2ccco2)c1)c1ccc(F)cc1F.
What is the InChIKey of N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is VDWPGEIQYSKJKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F2N2O3/c1-12(16-8-7-14(21)11-17(16)22)23-19(25)13-4-2-5-15(10-13)24-20(26)18-6-3-9-27-18/h2-12H,1H3,(H,23,25)(H,24,26).
What are the key properties of N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide?
N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 370.36 g/mol, XLogP of 4.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-(2,4-difluorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 55821382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).