N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide

C16H12FN3O2 — CID 113021264

IUPACN-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(Nc2cccc(F)c2)nc1)c1ccco1
InChIInChI=1S/C16H12FN3O2/c17-11-3-1-4-12(9-11)19-15-7-6-13(10-18-15)20-16(21)14-5-2-8-22-14/h1-10H,(H,18,19)(H,20,21)
InChIKeyQZRFZYNQSLVAGX-UHFFFAOYSA-N
MW297.29 g/mol
LogP3.81
Rot. Bonds4

About N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide

N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide (PubChem CID 113021264) has the molecular formula C16H12FN3O2 and a molecular weight of 297.29 g/mol. Its IUPAC name is N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide
PubChem CID113021264
Molecular FormulaC16H12FN3O2
Molecular Weight297.29 g/mol
Exact Mass297.09
IUPAC NameN-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(Nc2cccc(F)c2)nc1)c1ccco1
InChIInChI=1S/C16H12FN3O2/c17-11-3-1-4-12(9-11)19-15-7-6-13(10-18-15)20-16(21)14-5-2-8-22-14/h1-10H,(H,18,19)(H,20,21)
InChIKeyQZRFZYNQSLVAGX-UHFFFAOYSA-N
XLogP3.81
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.29
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3-acetamidoanilino)-3-pyridinyl]furan-2-carboxamide
CID 113020477
N-[6-(3,4-dimethylanilino)-3-pyridinyl]furan-2-carboxamide
CID 113016955
N-[5-(3-methylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113031417
N-(4-fluorophenyl)furan-2-carboxamide
CID 531893
N-[6-(3-fluoroanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113021257
N-[6-(3-acetylanilino)-3-pyridinyl]-3-fluorobenzamide
CID 113020314
N-[6-(quinolin-8-ylamino)-3-pyridinyl]furan-2-carboxamide
CID 113021727
N-(6-anilino-3-pyridinyl)-2-(3-fluorophenyl)acetamide
CID 113016055
ethyl 4-[[5-(furan-2-carbonylamino)-2-pyridinyl]amino]benzoate
CID 113021798
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
CID 113028255
2-ethyl-N-[6-(3-fluoroanilino)-3-pyridinyl]butanamide
CID 113021263
N-[5-(3,4-dimethylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032100

Frequently Asked Questions

What is the IUPAC name of N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide (CID 113021264) is N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide is O=C(Nc1ccc(Nc2cccc(F)c2)nc1)c1ccco1.
What is the InChIKey of N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide?
The InChIKey is QZRFZYNQSLVAGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN3O2/c17-11-3-1-4-12(9-11)19-15-7-6-13(10-18-15)20-16(21)14-5-2-8-22-14/h1-10H,(H,18,19)(H,20,21).
What are the key properties of N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide?
N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide has a molecular weight of 297.29 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 113021264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).