4-amino-5-ethylpyridine-2-carbonitrile

C8H9N3 — CID 126485327

IUPAC4-amino-5-ethylpyridine-2-carbonitrile
SMILESCCc1cnc(C#N)cc1N
InChIInChI=1S/C8H9N3/c1-2-6-5-11-7(4-9)3-8(6)10/h3,5H,2H2,1H3,(H2,10,11)
InChIKeyCVBHWWQSYCAEOW-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.10
Rot. Bonds1

About 4-amino-5-ethylpyridine-2-carbonitrile

4-amino-5-ethylpyridine-2-carbonitrile (PubChem CID 126485327) has the molecular formula C8H9N3 and a molecular weight of 147.18 g/mol. Its IUPAC name is 4-amino-5-ethylpyridine-2-carbonitrile.

Molecular Properties

Compound Name4-amino-5-ethylpyridine-2-carbonitrile
PubChem CID126485327
Molecular FormulaC8H9N3
Molecular Weight147.18 g/mol
Exact Mass147.08
IUPAC Name4-amino-5-ethylpyridine-2-carbonitrile
SMILESCCc1cnc(C#N)cc1N
InChIInChI=1S/C8H9N3/c1-2-6-5-11-7(4-9)3-8(6)10/h3,5H,2H2,1H3,(H2,10,11)
InChIKeyCVBHWWQSYCAEOW-UHFFFAOYSA-N
XLogP1.10
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-ethylpyridine-2-carbonitrile?
The IUPAC name of 4-amino-5-ethylpyridine-2-carbonitrile (CID 126485327) is 4-amino-5-ethylpyridine-2-carbonitrile.
What is the SMILES notation for 4-amino-5-ethylpyridine-2-carbonitrile?
The canonical SMILES for 4-amino-5-ethylpyridine-2-carbonitrile is CCc1cnc(C#N)cc1N.
What is the InChIKey of 4-amino-5-ethylpyridine-2-carbonitrile?
The InChIKey is CVBHWWQSYCAEOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3/c1-2-6-5-11-7(4-9)3-8(6)10/h3,5H,2H2,1H3,(H2,10,11).
What are the key properties of 4-amino-5-ethylpyridine-2-carbonitrile?
4-amino-5-ethylpyridine-2-carbonitrile has a molecular weight of 147.18 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-ethylpyridine-2-carbonitrile is sourced from PubChem (CID 126485327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).