4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid

C7H9N3O2 — CID 25029530

IUPAC4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid
SMILESO=C(O)C1CNCc2cn[nH]c21
InChIInChI=1S/C7H9N3O2/c11-7(12)5-3-8-1-4-2-9-10-6(4)5/h2,5,8H,1,3H2,(H,9,10)(H,11,12)
InChIKeyHEZXKJUQCKGSIZ-UHFFFAOYSA-N
MW167.17 g/mol
LogP-0.32
Rot. Bonds1

About 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid

4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid (PubChem CID 25029530) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid
PubChem CID25029530
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid
SMILESO=C(O)C1CNCc2cn[nH]c21
InChIInChI=1S/C7H9N3O2/c11-7(12)5-3-8-1-4-2-9-10-6(4)5/h2,5,8H,1,3H2,(H,9,10)(H,11,12)
InChIKeyHEZXKJUQCKGSIZ-UHFFFAOYSA-N
XLogP-0.32
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-(tert-butoxycarbonyl)-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridine-7-carboxylic acid
CID 59430421
methyl 1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-7-carboxylate hydrochloride
CID 154843145
methyl 1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-7-carboxylate
CID 131258952
1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-5-carboxylic acid
CID 165664239
1-[(5-tert-butyl-1H-pyrazol-4-yl)methyl]-5,5-difluoropiperidine-3-carboxylic acid
CID 166267939
6-(2,2,2-trifluoroacetyl)-2H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-4-carboxylic acid
CID 167729246
2-Amino-3-(1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl)propanoic acid
CID 21102109
2-(4-methyl-1H-pyrazol-5-yl)acetic acid
CID 55299222
5-tert-Butyl 7-ethyl 6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5,7(4H)-dicarboxylate
CID 59430425
5-(3,3-Dimethylbutoxycarbonyl)-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-7-carboxylic acid
CID 69316203
CID 89040180
CID 89040180
3-formamido-2-(1H-pyrazol-5-yl)propanoic acid
CID 129204543

Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid?
The IUPAC name of 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid (CID 25029530) is 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid.
What is the SMILES notation for 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid?
The canonical SMILES for 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid is O=C(O)C1CNCc2cn[nH]c21.
What is the InChIKey of 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid?
The InChIKey is HEZXKJUQCKGSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c11-7(12)5-3-8-1-4-2-9-10-6(4)5/h2,5,8H,1,3H2,(H,9,10)(H,11,12).
What are the key properties of 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid?
4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid has a molecular weight of 167.17 g/mol, XLogP of -0.32, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine-7-carboxylic acid is sourced from PubChem (CID 25029530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).