4-ethenylpyridine;2-hydroxypropanoate

C10H12NO3- — CID 21427738

IUPAC4-ethenylpyridine;2-hydroxypropanoate
SMILESC=Cc1ccncc1.CC(O)C(=O)[O-]
InChIInChI=1S/C7H7N.C3H6O3/c1-2-7-3-5-8-6-4-7;1-2(4)3(5)6/h2-6H,1H2;2,4H,1H3,(H,5,6)/p-1
InChIKeyHGCRZQLFQXJCEJ-UHFFFAOYSA-M
MW194.21 g/mol
LogP-0.16
Rot. Bonds2

About 4-ethenylpyridine;2-hydroxypropanoate

4-ethenylpyridine;2-hydroxypropanoate (PubChem CID 21427738) has the molecular formula C10H12NO3- and a molecular weight of 194.21 g/mol. Its IUPAC name is 4-ethenylpyridine;2-hydroxypropanoate.

Molecular Properties

Compound Name4-ethenylpyridine;2-hydroxypropanoate
PubChem CID21427738
Molecular FormulaC10H12NO3-
Molecular Weight194.21 g/mol
Exact Mass194.08
IUPAC Name4-ethenylpyridine;2-hydroxypropanoate
SMILESC=Cc1ccncc1.CC(O)C(=O)[O-]
InChIInChI=1S/C7H7N.C3H6O3/c1-2-7-3-5-8-6-4-7;1-2(4)3(5)6/h2-6H,1H2;2,4H,1H3,(H,5,6)/p-1
InChIKeyHGCRZQLFQXJCEJ-UHFFFAOYSA-M
XLogP-0.16
TPSA73.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.21
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-ethenylpyridine;2-hydroxypropanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-ethenylpyridine;2-hydroxypropanoate?
The IUPAC name of 4-ethenylpyridine;2-hydroxypropanoate (CID 21427738) is 4-ethenylpyridine;2-hydroxypropanoate.
What is the SMILES notation for 4-ethenylpyridine;2-hydroxypropanoate?
The canonical SMILES for 4-ethenylpyridine;2-hydroxypropanoate is C=Cc1ccncc1.CC(O)C(=O)[O-].
What is the InChIKey of 4-ethenylpyridine;2-hydroxypropanoate?
The InChIKey is HGCRZQLFQXJCEJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H7N.C3H6O3/c1-2-7-3-5-8-6-4-7;1-2(4)3(5)6/h2-6H,1H2;2,4H,1H3,(H,5,6)/p-1.
What are the key properties of 4-ethenylpyridine;2-hydroxypropanoate?
4-ethenylpyridine;2-hydroxypropanoate has a molecular weight of 194.21 g/mol, XLogP of -0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenylpyridine;2-hydroxypropanoate is sourced from PubChem (CID 21427738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).