4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid

C10H14N2O3 — CID 83909533

IUPAC4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid
SMILESCc1c2c(nn1C)CCCC2(O)C(=O)O
InChIInChI=1S/C10H14N2O3/c1-6-8-7(11-12(6)2)4-3-5-10(8,15)9(13)14/h15H,3-5H2,1-2H3,(H,13,14)
InChIKeyOMEJAXCHCQQNEK-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.34
Rot. Bonds1

About 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid

4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid (PubChem CID 83909533) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid.

Molecular Properties

Compound Name4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid
PubChem CID83909533
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid
SMILESCc1c2c(nn1C)CCCC2(O)C(=O)O
InChIInChI=1S/C10H14N2O3/c1-6-8-7(11-12(6)2)4-3-5-10(8,15)9(13)14/h15H,3-5H2,1-2H3,(H,13,14)
InChIKeyOMEJAXCHCQQNEK-UHFFFAOYSA-N
XLogP0.34
TPSA75.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2H-Indazole-3-acetic acid, 4,5,6,7-tetrahydro-2-methyl-
CID 210809
1-Methyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
CID 24271319
4-(Carboxymethyl)-1-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic acid
CID 82591243
3-Ethyl-1-methyl-4,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 83861907
1,3-Dimethyl-4,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 83861914
3-Cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 83861917
4-hydroxy-1-methyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
CID 83863570
2-(4-Hydroxy-1-methyl-4,5,6,7-tetrahydroindazol-3-yl)acetic acid
CID 83863572
2-(4-Hydroxy-2-methyl-4,5,6,7-tetrahydroindazol-3-yl)acetic acid
CID 83863690
2,3-Dimethyl-4,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 83907720
4-Hydroxy-3-methyl-2,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 83907960
4-Hydroxy-1,3-dimethyl-5,6-dihydrocyclopenta[d]pyrazole-4-carboxylic acid
CID 83907961

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid?
The IUPAC name of 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid (CID 83909533) is 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid.
What is the SMILES notation for 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid?
The canonical SMILES for 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid is Cc1c2c(nn1C)CCCC2(O)C(=O)O.
What is the InChIKey of 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid?
The InChIKey is OMEJAXCHCQQNEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6-8-7(11-12(6)2)4-3-5-10(8,15)9(13)14/h15H,3-5H2,1-2H3,(H,13,14).
What are the key properties of 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid?
4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid has a molecular weight of 210.23 g/mol, XLogP of 0.34, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2,3-dimethyl-6,7-dihydro-5H-indazole-4-carboxylic acid is sourced from PubChem (CID 83909533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).