(6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid

C10H12N2O4 — CID 172799899

IUPAC(6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid
SMILESC[C@@H]1Cc2[nH]nc(C(=O)O)c2CC1C(=O)O
InChIInChI=1S/C10H12N2O4/c1-4-2-7-6(3-5(4)9(13)14)8(10(15)16)12-11-7/h4-5H,2-3H2,1H3,(H,11,12)(H,13,14)(H,15,16)/t4-,5?/m1/s1
InChIKeyQSIDTSYXDHGCMZ-CNZKWPKMSA-N
MW224.22 g/mol
LogP0.54
Rot. Bonds2

About (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid

(6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid (PubChem CID 172799899) has the molecular formula C10H12N2O4 and a molecular weight of 224.22 g/mol. Its IUPAC name is (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid.

Molecular Properties

Compound Name(6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid
PubChem CID172799899
Molecular FormulaC10H12N2O4
Molecular Weight224.22 g/mol
Exact Mass224.08
IUPAC Name(6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid
SMILESC[C@@H]1Cc2[nH]nc(C(=O)O)c2CC1C(=O)O
InChIInChI=1S/C10H12N2O4/c1-4-2-7-6(3-5(4)9(13)14)8(10(15)16)12-11-7/h4-5H,2-3H2,1H3,(H,11,12)(H,13,14)(H,15,16)/t4-,5?/m1/s1
InChIKeyQSIDTSYXDHGCMZ-CNZKWPKMSA-N
XLogP0.54
TPSA103.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid?
The IUPAC name of (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid (CID 172799899) is (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid.
What is the SMILES notation for (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid?
The canonical SMILES for (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid is C[C@@H]1Cc2[nH]nc(C(=O)O)c2CC1C(=O)O.
What is the InChIKey of (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid?
The InChIKey is QSIDTSYXDHGCMZ-CNZKWPKMSA-N. The full InChI is InChI=1S/C10H12N2O4/c1-4-2-7-6(3-5(4)9(13)14)8(10(15)16)12-11-7/h4-5H,2-3H2,1H3,(H,11,12)(H,13,14)(H,15,16)/t4-,5?/m1/s1.
What are the key properties of (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid?
(6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid has a molecular weight of 224.22 g/mol, XLogP of 0.54, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-methyl-4,5,6,7-tetrahydro-1H-indazole-3,5-dicarboxylic acid is sourced from PubChem (CID 172799899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).