5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide

C20H14F2N4O2 — CID 155068995

IUPAC5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide
SMILESCn1cnc(-c2ccc(F)cc2)c1-c1ccc(C(=O)Nc2ccncc2F)o1
InChIInChI=1S/C20H14F2N4O2/c1-26-11-24-18(12-2-4-13(21)5-3-12)19(26)16-6-7-17(28-16)20(27)25-15-8-9-23-10-14(15)22/h2-11H,1H3,(H,23,25,27)
InChIKeyPEHIOUMFOJNZEZ-UHFFFAOYSA-N
MW380.35 g/mol
LogP4.27
Rot. Bonds4

About 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide

5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide (PubChem CID 155068995) has the molecular formula C20H14F2N4O2 and a molecular weight of 380.35 g/mol. Its IUPAC name is 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide
PubChem CID155068995
Molecular FormulaC20H14F2N4O2
Molecular Weight380.35 g/mol
Exact Mass380.11
IUPAC Name5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide
SMILESCn1cnc(-c2ccc(F)cc2)c1-c1ccc(C(=O)Nc2ccncc2F)o1
InChIInChI=1S/C20H14F2N4O2/c1-26-11-24-18(12-2-4-13(21)5-3-12)19(26)16-6-7-17(28-16)20(27)25-15-8-9-23-10-14(15)22/h2-11H,1H3,(H,23,25,27)
InChIKeyPEHIOUMFOJNZEZ-UHFFFAOYSA-N
XLogP4.27
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.35
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide?
The IUPAC name of 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide (CID 155068995) is 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide.
What is the SMILES notation for 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide?
The canonical SMILES for 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide is Cn1cnc(-c2ccc(F)cc2)c1-c1ccc(C(=O)Nc2ccncc2F)o1.
What is the InChIKey of 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide?
The InChIKey is PEHIOUMFOJNZEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F2N4O2/c1-26-11-24-18(12-2-4-13(21)5-3-12)19(26)16-6-7-17(28-16)20(27)25-15-8-9-23-10-14(15)22/h2-11H,1H3,(H,23,25,27).
What are the key properties of 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide?
5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide has a molecular weight of 380.35 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-N-(3-fluoro-4-pyridinyl)furan-2-carboxamide is sourced from PubChem (CID 155068995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).