2-aminopyridine-3-carbonitrile;ethane

C8H11N3 — CID 144683018

IUPAC2-aminopyridine-3-carbonitrile;ethane
SMILESCC.N#Cc1cccnc1N
InChIInChI=1S/C6H5N3.C2H6/c7-4-5-2-1-3-9-6(5)8;1-2/h1-3H,(H2,8,9);1-2H3
InChIKeyJWNFNSYEYRUMLG-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.56
Rot. Bonds

About 2-aminopyridine-3-carbonitrile;ethane

2-aminopyridine-3-carbonitrile;ethane (PubChem CID 144683018) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 2-aminopyridine-3-carbonitrile;ethane.

Molecular Properties

Compound Name2-aminopyridine-3-carbonitrile;ethane
PubChem CID144683018
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name2-aminopyridine-3-carbonitrile;ethane
SMILESCC.N#Cc1cccnc1N
InChIInChI=1S/C6H5N3.C2H6/c7-4-5-2-1-3-9-6(5)8;1-2/h1-3H,(H2,8,9);1-2H3
InChIKeyJWNFNSYEYRUMLG-UHFFFAOYSA-N
XLogP1.56
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-aminopyridine-3-carbonitrile;ethane?
The IUPAC name of 2-aminopyridine-3-carbonitrile;ethane (CID 144683018) is 2-aminopyridine-3-carbonitrile;ethane.
What is the SMILES notation for 2-aminopyridine-3-carbonitrile;ethane?
The canonical SMILES for 2-aminopyridine-3-carbonitrile;ethane is CC.N#Cc1cccnc1N.
What is the InChIKey of 2-aminopyridine-3-carbonitrile;ethane?
The InChIKey is JWNFNSYEYRUMLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3.C2H6/c7-4-5-2-1-3-9-6(5)8;1-2/h1-3H,(H2,8,9);1-2H3.
What are the key properties of 2-aminopyridine-3-carbonitrile;ethane?
2-aminopyridine-3-carbonitrile;ethane has a molecular weight of 149.20 g/mol, XLogP of 1.56, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopyridine-3-carbonitrile;ethane is sourced from PubChem (CID 144683018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).