N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide

C17H13FN2O2 — CID 166873662

IUPACN-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide
SMILESCc1cc(F)ccc1-c1cc(NC(=O)c2ccco2)ccn1
InChIInChI=1S/C17H13FN2O2/c1-11-9-12(18)4-5-14(11)15-10-13(6-7-19-15)20-17(21)16-3-2-8-22-16/h2-10H,1H3,(H,19,20,21)
InChIKeyTWFFFBCVZVSQNR-UHFFFAOYSA-N
MW296.30 g/mol
LogP4.04
Rot. Bonds3

About N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide

N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide (PubChem CID 166873662) has the molecular formula C17H13FN2O2 and a molecular weight of 296.30 g/mol. Its IUPAC name is N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide
PubChem CID166873662
Molecular FormulaC17H13FN2O2
Molecular Weight296.30 g/mol
Exact Mass296.10
IUPAC NameN-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide
SMILESCc1cc(F)ccc1-c1cc(NC(=O)c2ccco2)ccn1
InChIInChI=1S/C17H13FN2O2/c1-11-9-12(18)4-5-14(11)15-10-13(6-7-19-15)20-17(21)16-3-2-8-22-16/h2-10H,1H3,(H,19,20,21)
InChIKeyTWFFFBCVZVSQNR-UHFFFAOYSA-N
XLogP4.04
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.30
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-fluoro-2-methylphenyl)furan-2-carboxamide
CID 4275844
N-[4-[(4-fluoro-2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 9426257
N-(4-fluorophenyl)furan-2-carboxamide
CID 531893
N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 689600
N-[4-[4-(2,4-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]furan-2-carboxamide
CID 46392772
N-(2,3-dimethylquinoxalin-6-yl)furan-2-carboxamide
CID 3734340
N-(2,5-difluorophenyl)furan-2-carboxamide
CID 2711385
N-[2-(4-fluorophenyl)benzotriazol-5-yl]furan-2-carboxamide
CID 952245
N-[5-[(4-fluorophenyl)carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 17491245
N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide
CID 113021264
N-[4-[N-[(3-fluorobenzoyl)amino]-C-methylcarbonimidoyl]phenyl]furan-2-carboxamide
CID 3270950
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide (CID 166873662) is N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide is Cc1cc(F)ccc1-c1cc(NC(=O)c2ccco2)ccn1.
What is the InChIKey of N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide?
The InChIKey is TWFFFBCVZVSQNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2O2/c1-11-9-12(18)4-5-14(11)15-10-13(6-7-19-15)20-17(21)16-3-2-8-22-16/h2-10H,1H3,(H,19,20,21).
What are the key properties of N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide?
N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide has a molecular weight of 296.30 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluoro-2-methylphenyl)-4-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 166873662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).