6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile

C10H8N4O — CID 171091306

IUPAC6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile
SMILESCc1cc(-c2noc(C)n2)cc(C#N)n1
InChIInChI=1S/C10H8N4O/c1-6-3-8(4-9(5-11)12-6)10-13-7(2)15-14-10/h3-4H,1-2H3
InChIKeyJNHSKENMVQCMAE-UHFFFAOYSA-N
MW200.20 g/mol
LogP1.62
Rot. Bonds1

About 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile

6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile (PubChem CID 171091306) has the molecular formula C10H8N4O and a molecular weight of 200.20 g/mol. Its IUPAC name is 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile
PubChem CID171091306
Molecular FormulaC10H8N4O
Molecular Weight200.20 g/mol
Exact Mass200.07
IUPAC Name6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile
SMILESCc1cc(-c2noc(C)n2)cc(C#N)n1
InChIInChI=1S/C10H8N4O/c1-6-3-8(4-9(5-11)12-6)10-13-7(2)15-14-10/h3-4H,1-2H3
InChIKeyJNHSKENMVQCMAE-UHFFFAOYSA-N
XLogP1.62
TPSA75.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile?
The IUPAC name of 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile (CID 171091306) is 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile.
What is the SMILES notation for 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile?
The canonical SMILES for 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile is Cc1cc(-c2noc(C)n2)cc(C#N)n1.
What is the InChIKey of 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile?
The InChIKey is JNHSKENMVQCMAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O/c1-6-3-8(4-9(5-11)12-6)10-13-7(2)15-14-10/h3-4H,1-2H3.
What are the key properties of 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile?
6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile has a molecular weight of 200.20 g/mol, XLogP of 1.62, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridine-2-carbonitrile is sourced from PubChem (CID 171091306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).