6-amino-2-ethylpyridine-3-carboxylic acid

C8H10N2O2 — CID 22019116

IUPAC6-amino-2-ethylpyridine-3-carboxylic acid
SMILESCCc1nc(N)ccc1C(=O)O
InChIInChI=1S/C8H10N2O2/c1-2-6-5(8(11)12)3-4-7(9)10-6/h3-4H,2H2,1H3,(H2,9,10)(H,11,12)
InChIKeyBQLSSGOUEBSPRW-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.92
Rot. Bonds2

About 6-amino-2-ethylpyridine-3-carboxylic acid

6-amino-2-ethylpyridine-3-carboxylic acid (PubChem CID 22019116) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 6-amino-2-ethylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-amino-2-ethylpyridine-3-carboxylic acid
PubChem CID22019116
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name6-amino-2-ethylpyridine-3-carboxylic acid
SMILESCCc1nc(N)ccc1C(=O)O
InChIInChI=1S/C8H10N2O2/c1-2-6-5(8(11)12)3-4-7(9)10-6/h3-4H,2H2,1H3,(H2,9,10)(H,11,12)
InChIKeyBQLSSGOUEBSPRW-UHFFFAOYSA-N
XLogP0.92
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-ethylpyridine-3-carboxylic acid?
The IUPAC name of 6-amino-2-ethylpyridine-3-carboxylic acid (CID 22019116) is 6-amino-2-ethylpyridine-3-carboxylic acid.
What is the SMILES notation for 6-amino-2-ethylpyridine-3-carboxylic acid?
The canonical SMILES for 6-amino-2-ethylpyridine-3-carboxylic acid is CCc1nc(N)ccc1C(=O)O.
What is the InChIKey of 6-amino-2-ethylpyridine-3-carboxylic acid?
The InChIKey is BQLSSGOUEBSPRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-2-6-5(8(11)12)3-4-7(9)10-6/h3-4H,2H2,1H3,(H2,9,10)(H,11,12).
What are the key properties of 6-amino-2-ethylpyridine-3-carboxylic acid?
6-amino-2-ethylpyridine-3-carboxylic acid has a molecular weight of 166.18 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-ethylpyridine-3-carboxylic acid is sourced from PubChem (CID 22019116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).