6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid

C19H15N5O2 — CID 122478395

IUPAC6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCc1cccc(-c2ncc(N)cc2-c2ccc3ncc(C(=O)O)n3c2)n1
InChIInChI=1S/C19H15N5O2/c1-11-3-2-4-15(23-11)18-14(7-13(20)8-22-18)12-5-6-17-21-9-16(19(25)26)24(17)10-12/h2-10H,20H2,1H3,(H,25,26)
InChIKeyPNRLXHVPYLGZKU-UHFFFAOYSA-N
MW345.36 g/mol
LogP3.05
Rot. Bonds3

About 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid

6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 122478395) has the molecular formula C19H15N5O2 and a molecular weight of 345.36 g/mol. Its IUPAC name is 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID122478395
Molecular FormulaC19H15N5O2
Molecular Weight345.36 g/mol
Exact Mass345.12
IUPAC Name6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCc1cccc(-c2ncc(N)cc2-c2ccc3ncc(C(=O)O)n3c2)n1
InChIInChI=1S/C19H15N5O2/c1-11-3-2-4-15(23-11)18-14(7-13(20)8-22-18)12-5-6-17-21-9-16(19(25)26)24(17)10-12/h2-10H,20H2,1H3,(H,25,26)
InChIKeyPNRLXHVPYLGZKU-UHFFFAOYSA-N
XLogP3.05
TPSA106.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid (CID 122478395) is 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid is Cc1cccc(-c2ncc(N)cc2-c2ccc3ncc(C(=O)O)n3c2)n1.
What is the InChIKey of 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is PNRLXHVPYLGZKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O2/c1-11-3-2-4-15(23-11)18-14(7-13(20)8-22-18)12-5-6-17-21-9-16(19(25)26)24(17)10-12/h2-10H,20H2,1H3,(H,25,26).
What are the key properties of 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid?
6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 345.36 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-amino-2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 122478395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).