2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid

C8H11N3O2 — CID 90040560

IUPAC2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid
SMILESCn1cc2c(n1)CCCN2C(=O)O
InChIInChI=1S/C8H11N3O2/c1-10-5-7-6(9-10)3-2-4-11(7)8(12)13/h5H,2-4H2,1H3,(H,12,13)
InChIKeyCAVVASOPAZCOSJ-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.85
Rot. Bonds

About 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid

2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid (PubChem CID 90040560) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid
PubChem CID90040560
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC Name2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid
SMILESCn1cc2c(n1)CCCN2C(=O)O
InChIInChI=1S/C8H11N3O2/c1-10-5-7-6(9-10)3-2-4-11(7)8(12)13/h5H,2-4H2,1H3,(H,12,13)
InChIKeyCAVVASOPAZCOSJ-UHFFFAOYSA-N
XLogP0.85
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2,2-Difluoroethyl)-4,5,6,7-tetrahydropyrazolo[4,5-b]pyridin-7-yl]carbamic acid
CID 134278545
4-fluoro-N,N-dimethyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-amine
CID 146613142
4,4-difluoro-N,N-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-3-amine
CID 146617417
1-[5-(difluoromethyl)-1-methyl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-4-yl]-2-fluoroprop-2-en-1-one
CID 167982328
1,5,6,7-Tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid
CID 20784737
1,4-di(propan-2-yl)-6,7-dihydro-5H-pyrazolo[4,5-b]pyridine
CID 58110724
N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)acetamide
CID 58464816
1-(4,5,6,7-Tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyrrole-2,5-dione
CID 67465628
2-Methyl-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-b]pyridine
CID 86767714
2-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxylic acid
CID 89500164
4-[Cyano-(1-methylpyrazol-3-yl)methyl]piperazine-1-carboxylic acid
CID 89559737
1,4-dimethyl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridine
CID 89591085

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid?
The IUPAC name of 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid (CID 90040560) is 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid?
The canonical SMILES for 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid is Cn1cc2c(n1)CCCN2C(=O)O.
What is the InChIKey of 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid?
The InChIKey is CAVVASOPAZCOSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c1-10-5-7-6(9-10)3-2-4-11(7)8(12)13/h5H,2-4H2,1H3,(H,12,13).
What are the key properties of 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid?
2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid has a molecular weight of 181.19 g/mol, XLogP of 0.85, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6,7-dihydro-5H-pyrazolo[4,3-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 90040560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).