2-propan-2-ylindazol-5-ol

C10H12N2O — CID 84717775

IUPAC2-propan-2-ylindazol-5-ol
SMILESCC(C)n1cc2cc(O)ccc2n1
InChIInChI=1S/C10H12N2O/c1-7(2)12-6-8-5-9(13)3-4-10(8)11-12/h3-7,13H,1-2H3
InChIKeyXUJWHUATKIUDBW-UHFFFAOYSA-N
MW176.22 g/mol
LogP2.32
Rot. Bonds1

About 2-propan-2-ylindazol-5-ol

2-propan-2-ylindazol-5-ol (PubChem CID 84717775) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 2-propan-2-ylindazol-5-ol.

Molecular Properties

Compound Name2-propan-2-ylindazol-5-ol
PubChem CID84717775
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name2-propan-2-ylindazol-5-ol
SMILESCC(C)n1cc2cc(O)ccc2n1
InChIInChI=1S/C10H12N2O/c1-7(2)12-6-8-5-9(13)3-4-10(8)11-12/h3-7,13H,1-2H3
InChIKeyXUJWHUATKIUDBW-UHFFFAOYSA-N
XLogP2.32
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-propan-2-ylindazol-5-yl)methanol
CID 90356269
2-propan-2-ylindazole-5-carbonitrile
CID 84718934
ethane;2-methylpropane;2-propan-2-ylindazole
CID 159582971
N-methyl-1-(2-propan-2-ylindazol-5-yl)ethanamine
CID 84724099
2-(2-propan-2-ylindazol-5-yl)ethanamine
CID 84721669
2-oxo-2-[4-(2-propan-2-ylindazol-5-yl)phenyl]acetamide
CID 144811408
6-chloro-2-propan-2-ylindazole
CID 84720409
2,5-di(propan-2-yl)pyrazolo[4,3-b]pyridine
CID 177260557
2-propan-2-ylindazol-7-ol
CID 84717779
6-(2-methylpropyl)-2-propan-2-ylindazole
CID 155051024
2-propan-2-ylindazole-6-carbaldehyde
CID 84719145
6-methyl-2-propan-2-ylpyrazolo[4,3-c]pyridine
CID 171089700

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-ylindazol-5-ol?
The IUPAC name of 2-propan-2-ylindazol-5-ol (CID 84717775) is 2-propan-2-ylindazol-5-ol.
What is the SMILES notation for 2-propan-2-ylindazol-5-ol?
The canonical SMILES for 2-propan-2-ylindazol-5-ol is CC(C)n1cc2cc(O)ccc2n1.
What is the InChIKey of 2-propan-2-ylindazol-5-ol?
The InChIKey is XUJWHUATKIUDBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-7(2)12-6-8-5-9(13)3-4-10(8)11-12/h3-7,13H,1-2H3.
What are the key properties of 2-propan-2-ylindazol-5-ol?
2-propan-2-ylindazol-5-ol has a molecular weight of 176.22 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-ylindazol-5-ol is sourced from PubChem (CID 84717775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).