5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile

C14H8FN5O — CID 155585151

IUPAC5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile
SMILESN#Cc1ccc(Nc2ncc(-c3ccc(F)cn3)o2)cn1
InChIInChI=1S/C14H8FN5O/c15-9-1-4-12(18-6-9)13-8-19-14(21-13)20-11-3-2-10(5-16)17-7-11/h1-4,6-8H,(H,19,20)
InChIKeyCKRSZSPCDLDDON-UHFFFAOYSA-N
MW281.25 g/mol
LogP2.89
Rot. Bonds3

About 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile

5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile (PubChem CID 155585151) has the molecular formula C14H8FN5O and a molecular weight of 281.25 g/mol. Its IUPAC name is 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile
PubChem CID155585151
Molecular FormulaC14H8FN5O
Molecular Weight281.25 g/mol
Exact Mass281.07
IUPAC Name5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile
SMILESN#Cc1ccc(Nc2ncc(-c3ccc(F)cn3)o2)cn1
InChIInChI=1S/C14H8FN5O/c15-9-1-4-12(18-6-9)13-8-19-14(21-13)20-11-3-2-10(5-16)17-7-11/h1-4,6-8H,(H,19,20)
InChIKeyCKRSZSPCDLDDON-UHFFFAOYSA-N
XLogP2.89
TPSA87.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.25
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile?
The IUPAC name of 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile (CID 155585151) is 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile?
The canonical SMILES for 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile is N#Cc1ccc(Nc2ncc(-c3ccc(F)cn3)o2)cn1.
What is the InChIKey of 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile?
The InChIKey is CKRSZSPCDLDDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8FN5O/c15-9-1-4-12(18-6-9)13-8-19-14(21-13)20-11-3-2-10(5-16)17-7-11/h1-4,6-8H,(H,19,20).
What are the key properties of 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile?
5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile has a molecular weight of 281.25 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[5-(5-fluoro-2-pyridinyl)-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile is sourced from PubChem (CID 155585151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).