6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid

C14H10N4O2 — CID 126768438

IUPAC6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid
SMILESO=C(O)c1cc(C=Cc2cnc3ccccn23)ncn1
InChIInChI=1S/C14H10N4O2/c19-14(20)12-7-10(16-9-17-12)4-5-11-8-15-13-3-1-2-6-18(11)13/h1-9H,(H,19,20)
InChIKeyWUYDGLSMRIWWNY-UHFFFAOYSA-N
MW266.26 g/mol
LogP1.99
Rot. Bonds3

About 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid

6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid (PubChem CID 126768438) has the molecular formula C14H10N4O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid.

Molecular Properties

Compound Name6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid
PubChem CID126768438
Molecular FormulaC14H10N4O2
Molecular Weight266.26 g/mol
Exact Mass266.08
IUPAC Name6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid
SMILESO=C(O)c1cc(C=Cc2cnc3ccccn23)ncn1
InChIInChI=1S/C14H10N4O2/c19-14(20)12-7-10(16-9-17-12)4-5-11-8-15-13-3-1-2-6-18(11)13/h1-9H,(H,19,20)
InChIKeyWUYDGLSMRIWWNY-UHFFFAOYSA-N
XLogP1.99
TPSA80.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid?
The IUPAC name of 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid (CID 126768438) is 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid.
What is the SMILES notation for 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid?
The canonical SMILES for 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid is O=C(O)c1cc(C=Cc2cnc3ccccn23)ncn1.
What is the InChIKey of 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid?
The InChIKey is WUYDGLSMRIWWNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O2/c19-14(20)12-7-10(16-9-17-12)4-5-11-8-15-13-3-1-2-6-18(11)13/h1-9H,(H,19,20).
What are the key properties of 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid?
6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid has a molecular weight of 266.26 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-imidazo[1,2-a]pyridin-3-ylethenyl)pyrimidine-4-carboxylic acid is sourced from PubChem (CID 126768438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).