5-amino-6-methylpyridine-2-carbonitrile;ethane

C9H13N3 — CID 156814154

IUPAC5-amino-6-methylpyridine-2-carbonitrile;ethane
SMILESCC.Cc1nc(C#N)ccc1N
InChIInChI=1S/C7H7N3.C2H6/c1-5-7(9)3-2-6(4-8)10-5;1-2/h2-3H,9H2,1H3;1-2H3
InChIKeyYMNBNEPXUGOTFU-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.87
Rot. Bonds

About 5-amino-6-methylpyridine-2-carbonitrile;ethane

5-amino-6-methylpyridine-2-carbonitrile;ethane (PubChem CID 156814154) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 5-amino-6-methylpyridine-2-carbonitrile;ethane.

Molecular Properties

Compound Name5-amino-6-methylpyridine-2-carbonitrile;ethane
PubChem CID156814154
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name5-amino-6-methylpyridine-2-carbonitrile;ethane
SMILESCC.Cc1nc(C#N)ccc1N
InChIInChI=1S/C7H7N3.C2H6/c1-5-7(9)3-2-6(4-8)10-5;1-2/h2-3H,9H2,1H3;1-2H3
InChIKeyYMNBNEPXUGOTFU-UHFFFAOYSA-N
XLogP1.87
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-methylpyridine-2-carbonitrile;ethane?
The IUPAC name of 5-amino-6-methylpyridine-2-carbonitrile;ethane (CID 156814154) is 5-amino-6-methylpyridine-2-carbonitrile;ethane.
What is the SMILES notation for 5-amino-6-methylpyridine-2-carbonitrile;ethane?
The canonical SMILES for 5-amino-6-methylpyridine-2-carbonitrile;ethane is CC.Cc1nc(C#N)ccc1N.
What is the InChIKey of 5-amino-6-methylpyridine-2-carbonitrile;ethane?
The InChIKey is YMNBNEPXUGOTFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3.C2H6/c1-5-7(9)3-2-6(4-8)10-5;1-2/h2-3H,9H2,1H3;1-2H3.
What are the key properties of 5-amino-6-methylpyridine-2-carbonitrile;ethane?
5-amino-6-methylpyridine-2-carbonitrile;ethane has a molecular weight of 163.22 g/mol, XLogP of 1.87, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-methylpyridine-2-carbonitrile;ethane is sourced from PubChem (CID 156814154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).