7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid

C10H12N2O3 — CID 112716180

IUPAC7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid
SMILESO=C(O)C1(O)c2[nH]ncc2CCC12CC2
InChIInChI=1S/C10H12N2O3/c13-8(14)10(15)7-6(5-11-12-7)1-2-9(10)3-4-9/h5,15H,1-4H2,(H,11,12)(H,13,14)
InChIKeyOSVBZWIAPAUEKA-UHFFFAOYSA-N
MW208.22 g/mol
LogP0.41
Rot. Bonds1

About 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid

7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid (PubChem CID 112716180) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid.

Molecular Properties

Compound Name7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid
PubChem CID112716180
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid
SMILESO=C(O)C1(O)c2[nH]ncc2CCC12CC2
InChIInChI=1S/C10H12N2O3/c13-8(14)10(15)7-6(5-11-12-7)1-2-9(10)3-4-9/h5,15H,1-4H2,(H,11,12)(H,13,14)
InChIKeyOSVBZWIAPAUEKA-UHFFFAOYSA-N
XLogP0.41
TPSA86.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

7-Hydroxy-1,4,5,6-tetrahydroindazole-7-carboxylic acid
CID 82407998
4-Hydroxy-1,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 83906645
2-(7-Hydroxy-1,4,5,6-tetrahydroindazol-7-yl)acetic acid
CID 83907954
Spiro[1,4,5,7-tetrahydroindazole-6,1'-cyclopropane]-7-carboxylic acid
CID 112715028
7-(aminomethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol
CID 112715118
6,6-Dimethyl-1,4,5,7-tetrahydroindazole-7-carboxylic acid
CID 112715288
7-Hydroxy-6-methyl-1,4,5,6-tetrahydroindazole-7-carboxylic acid
CID 112715478
4-Hydroxy-5-methyl-1,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 112715480
7-aminospiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid
CID 112716012
7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol
CID 112716057
4-hydroxyspiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-carboxylic acid
CID 112716181
2-(7-Hydroxy-6-methyl-1,4,5,6-tetrahydroindazol-7-yl)acetic acid
CID 112716464

Frequently Asked Questions

What is the IUPAC name of 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid?
The IUPAC name of 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid (CID 112716180) is 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid.
What is the SMILES notation for 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid?
The canonical SMILES for 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid is O=C(O)C1(O)c2[nH]ncc2CCC12CC2.
What is the InChIKey of 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid?
The InChIKey is OSVBZWIAPAUEKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c13-8(14)10(15)7-6(5-11-12-7)1-2-9(10)3-4-9/h5,15H,1-4H2,(H,11,12)(H,13,14).
What are the key properties of 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid?
7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid has a molecular weight of 208.22 g/mol, XLogP of 0.41, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxyspiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-carboxylic acid is sourced from PubChem (CID 112716180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).