2-amino-6-methylpyridine-3,5-dicarbonitrile

C8H6N4 — CID 2786726

IUPAC2-amino-6-methylpyridine-3,5-dicarbonitrile
SMILESCc1nc(N)c(C#N)cc1C#N
InChIInChI=1S/C8H6N4/c1-5-6(3-9)2-7(4-10)8(11)12-5/h2H,1H3,(H2,11,12)
InChIKeyWDPUOYPYEKYTMM-UHFFFAOYSA-N
MW158.16 g/mol
LogP0.72
Rot. Bonds

About 2-amino-6-methylpyridine-3,5-dicarbonitrile

2-amino-6-methylpyridine-3,5-dicarbonitrile (PubChem CID 2786726) has the molecular formula C8H6N4 and a molecular weight of 158.16 g/mol. Its IUPAC name is 2-amino-6-methylpyridine-3,5-dicarbonitrile.

Molecular Properties

Compound Name2-amino-6-methylpyridine-3,5-dicarbonitrile
PubChem CID2786726
Molecular FormulaC8H6N4
Molecular Weight158.16 g/mol
Exact Mass158.06
IUPAC Name2-amino-6-methylpyridine-3,5-dicarbonitrile
SMILESCc1nc(N)c(C#N)cc1C#N
InChIInChI=1S/C8H6N4/c1-5-6(3-9)2-7(4-10)8(11)12-5/h2H,1H3,(H2,11,12)
InChIKeyWDPUOYPYEKYTMM-UHFFFAOYSA-N
XLogP0.72
TPSA86.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methylpyridine-3,5-dicarbonitrile?
The IUPAC name of 2-amino-6-methylpyridine-3,5-dicarbonitrile (CID 2786726) is 2-amino-6-methylpyridine-3,5-dicarbonitrile.
What is the SMILES notation for 2-amino-6-methylpyridine-3,5-dicarbonitrile?
The canonical SMILES for 2-amino-6-methylpyridine-3,5-dicarbonitrile is Cc1nc(N)c(C#N)cc1C#N.
What is the InChIKey of 2-amino-6-methylpyridine-3,5-dicarbonitrile?
The InChIKey is WDPUOYPYEKYTMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N4/c1-5-6(3-9)2-7(4-10)8(11)12-5/h2H,1H3,(H2,11,12).
What are the key properties of 2-amino-6-methylpyridine-3,5-dicarbonitrile?
2-amino-6-methylpyridine-3,5-dicarbonitrile has a molecular weight of 158.16 g/mol, XLogP of 0.72, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methylpyridine-3,5-dicarbonitrile is sourced from PubChem (CID 2786726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).