2-pyrimidin-2-ylpyridine-3-carboxylic acid

C10H7N3O2 — CID 23210098

IUPAC2-pyrimidin-2-ylpyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1-c1ncccn1
InChIInChI=1S/C10H7N3O2/c14-10(15)7-3-1-4-11-8(7)9-12-5-2-6-13-9/h1-6H,(H,14,15)
InChIKeyFNMXXQKJFJBVBU-UHFFFAOYSA-N
MW201.19 g/mol
LogP1.24
Rot. Bonds2

About 2-pyrimidin-2-ylpyridine-3-carboxylic acid

2-pyrimidin-2-ylpyridine-3-carboxylic acid (PubChem CID 23210098) has the molecular formula C10H7N3O2 and a molecular weight of 201.19 g/mol. Its IUPAC name is 2-pyrimidin-2-ylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-pyrimidin-2-ylpyridine-3-carboxylic acid
PubChem CID23210098
Molecular FormulaC10H7N3O2
Molecular Weight201.19 g/mol
Exact Mass201.05
IUPAC Name2-pyrimidin-2-ylpyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1-c1ncccn1
InChIInChI=1S/C10H7N3O2/c14-10(15)7-3-1-4-11-8(7)9-12-5-2-6-13-9/h1-6H,(H,14,15)
InChIKeyFNMXXQKJFJBVBU-UHFFFAOYSA-N
XLogP1.24
TPSA75.97 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-pyrimidin-2-ylpyridine-3-carboxylic acid?
The IUPAC name of 2-pyrimidin-2-ylpyridine-3-carboxylic acid (CID 23210098) is 2-pyrimidin-2-ylpyridine-3-carboxylic acid.
What is the SMILES notation for 2-pyrimidin-2-ylpyridine-3-carboxylic acid?
The canonical SMILES for 2-pyrimidin-2-ylpyridine-3-carboxylic acid is O=C(O)c1cccnc1-c1ncccn1.
What is the InChIKey of 2-pyrimidin-2-ylpyridine-3-carboxylic acid?
The InChIKey is FNMXXQKJFJBVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O2/c14-10(15)7-3-1-4-11-8(7)9-12-5-2-6-13-9/h1-6H,(H,14,15).
What are the key properties of 2-pyrimidin-2-ylpyridine-3-carboxylic acid?
2-pyrimidin-2-ylpyridine-3-carboxylic acid has a molecular weight of 201.19 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrimidin-2-ylpyridine-3-carboxylic acid is sourced from PubChem (CID 23210098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).