6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid

C19H15N5O2 — CID 10043174

IUPAC6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESO=C(O)c1cnc2ccc(-c3c(-c4ccccn4)nn4c3CCC4)cn12
InChIInChI=1S/C19H15N5O2/c25-19(26)15-10-21-16-7-6-12(11-23(15)16)17-14-5-3-9-24(14)22-18(17)13-4-1-2-8-20-13/h1-2,4,6-8,10-11H,3,5,9H2,(H,25,26)
InChIKeyZFRVAZLCPJBKRJ-UHFFFAOYSA-N
MW345.36 g/mol
LogP2.90
Rot. Bonds3

About 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid

6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 10043174) has the molecular formula C19H15N5O2 and a molecular weight of 345.36 g/mol. Its IUPAC name is 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID10043174
Molecular FormulaC19H15N5O2
Molecular Weight345.36 g/mol
Exact Mass345.12
IUPAC Name6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESO=C(O)c1cnc2ccc(-c3c(-c4ccccn4)nn4c3CCC4)cn12
InChIInChI=1S/C19H15N5O2/c25-19(26)15-10-21-16-7-6-12(11-23(15)16)17-14-5-3-9-24(14)22-18(17)13-4-1-2-8-20-13/h1-2,4,6-8,10-11H,3,5,9H2,(H,25,26)
InChIKeyZFRVAZLCPJBKRJ-UHFFFAOYSA-N
XLogP2.90
TPSA85.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid (CID 10043174) is 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid is O=C(O)c1cnc2ccc(-c3c(-c4ccccn4)nn4c3CCC4)cn12.
What is the InChIKey of 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is ZFRVAZLCPJBKRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O2/c25-19(26)15-10-21-16-7-6-12(11-23(15)16)17-14-5-3-9-24(14)22-18(17)13-4-1-2-8-20-13/h1-2,4,6-8,10-11H,3,5,9H2,(H,25,26).
What are the key properties of 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 345.36 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)imidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 10043174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).