(2-propan-2-ylindazol-5-yl)methanol

C11H14N2O — CID 90356269

IUPAC(2-propan-2-ylindazol-5-yl)methanol
SMILESCC(C)n1cc2cc(CO)ccc2n1
InChIInChI=1S/C11H14N2O/c1-8(2)13-6-10-5-9(7-14)3-4-11(10)12-13/h3-6,8,14H,7H2,1-2H3
InChIKeyBQYITPIURHKCIM-UHFFFAOYSA-N
MW190.25 g/mol
LogP2.11
Rot. Bonds2

About (2-propan-2-ylindazol-5-yl)methanol

(2-propan-2-ylindazol-5-yl)methanol (PubChem CID 90356269) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is (2-propan-2-ylindazol-5-yl)methanol.

Molecular Properties

Compound Name(2-propan-2-ylindazol-5-yl)methanol
PubChem CID90356269
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name(2-propan-2-ylindazol-5-yl)methanol
SMILESCC(C)n1cc2cc(CO)ccc2n1
InChIInChI=1S/C11H14N2O/c1-8(2)13-6-10-5-9(7-14)3-4-11(10)12-13/h3-6,8,14H,7H2,1-2H3
InChIKeyBQYITPIURHKCIM-UHFFFAOYSA-N
XLogP2.11
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-propan-2-ylindazol-5-yl)methanol?
The IUPAC name of (2-propan-2-ylindazol-5-yl)methanol (CID 90356269) is (2-propan-2-ylindazol-5-yl)methanol.
What is the SMILES notation for (2-propan-2-ylindazol-5-yl)methanol?
The canonical SMILES for (2-propan-2-ylindazol-5-yl)methanol is CC(C)n1cc2cc(CO)ccc2n1.
What is the InChIKey of (2-propan-2-ylindazol-5-yl)methanol?
The InChIKey is BQYITPIURHKCIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-8(2)13-6-10-5-9(7-14)3-4-11(10)12-13/h3-6,8,14H,7H2,1-2H3.
What are the key properties of (2-propan-2-ylindazol-5-yl)methanol?
(2-propan-2-ylindazol-5-yl)methanol has a molecular weight of 190.25 g/mol, XLogP of 2.11, 2 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-yl)methanol is sourced from PubChem (CID 90356269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).