2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile

C16H10FN3O — CID 10446308

IUPAC2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(F)cc2)cc(-c2ccco2)nc1N
InChIInChI=1S/C16H10FN3O/c17-11-5-3-10(4-6-11)12-8-14(15-2-1-7-21-15)20-16(19)13(12)9-18/h1-8H,(H2,19,20)
InChIKeyKYWCABSGOZQLPS-UHFFFAOYSA-N
MW279.27 g/mol
LogP3.60
Rot. Bonds2

About 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile

2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile (PubChem CID 10446308) has the molecular formula C16H10FN3O and a molecular weight of 279.27 g/mol. Its IUPAC name is 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile
PubChem CID10446308
Molecular FormulaC16H10FN3O
Molecular Weight279.27 g/mol
Exact Mass279.08
IUPAC Name2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(F)cc2)cc(-c2ccco2)nc1N
InChIInChI=1S/C16H10FN3O/c17-11-5-3-10(4-6-11)12-8-14(15-2-1-7-21-15)20-16(19)13(12)9-18/h1-8H,(H2,19,20)
InChIKeyKYWCABSGOZQLPS-UHFFFAOYSA-N
XLogP3.60
TPSA75.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.27
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile (CID 10446308) is 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile is N#Cc1c(-c2ccc(F)cc2)cc(-c2ccco2)nc1N.
What is the InChIKey of 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile?
The InChIKey is KYWCABSGOZQLPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN3O/c17-11-5-3-10(4-6-11)12-8-14(15-2-1-7-21-15)20-16(19)13(12)9-18/h1-8H,(H2,19,20).
What are the key properties of 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile?
2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile has a molecular weight of 279.27 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(4-fluorophenyl)-6-(furan-2-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 10446308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).