2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile

C19H12FN5O — CID 56873690

IUPAC2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccco2)cc(-c2cnn(-c3ccc(F)cc3)c2)nc1N
InChIInChI=1S/C19H12FN5O/c20-13-3-5-14(6-4-13)25-11-12(10-23-25)17-8-15(18-2-1-7-26-18)16(9-21)19(22)24-17/h1-8,10-11H,(H2,22,24)
InChIKeyXNJDJYPOSXLRPI-UHFFFAOYSA-N
MW345.34 g/mol
LogP3.79
Rot. Bonds3

About 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile

2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile (PubChem CID 56873690) has the molecular formula C19H12FN5O and a molecular weight of 345.34 g/mol. Its IUPAC name is 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile
PubChem CID56873690
Molecular FormulaC19H12FN5O
Molecular Weight345.34 g/mol
Exact Mass345.10
IUPAC Name2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccco2)cc(-c2cnn(-c3ccc(F)cc3)c2)nc1N
InChIInChI=1S/C19H12FN5O/c20-13-3-5-14(6-4-13)25-11-12(10-23-25)17-8-15(18-2-1-7-26-18)16(9-21)19(22)24-17/h1-8,10-11H,(H2,22,24)
InChIKeyXNJDJYPOSXLRPI-UHFFFAOYSA-N
XLogP3.79
TPSA93.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.34
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile (CID 56873690) is 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile is N#Cc1c(-c2ccco2)cc(-c2cnn(-c3ccc(F)cc3)c2)nc1N.
What is the InChIKey of 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile?
The InChIKey is XNJDJYPOSXLRPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12FN5O/c20-13-3-5-14(6-4-13)25-11-12(10-23-25)17-8-15(18-2-1-7-26-18)16(9-21)19(22)24-17/h1-8,10-11H,(H2,22,24).
What are the key properties of 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile?
2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile has a molecular weight of 345.34 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-[1-(4-fluorophenyl)pyrazol-4-yl]-4-(furan-2-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 56873690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).