(3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol

C9H14N2O — CID 123200606

IUPAC(3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol
SMILESCc1[nH]nc2c1CCC(CO)C2
InChIInChI=1S/C9H14N2O/c1-6-8-3-2-7(5-12)4-9(8)11-10-6/h7,12H,2-5H2,1H3,(H,10,11)
InChIKeyJJVQAPLANNTIFJ-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.82
Rot. Bonds1

About (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol

(3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol (PubChem CID 123200606) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol.

Molecular Properties

Compound Name(3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol
PubChem CID123200606
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name(3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol
SMILESCc1[nH]nc2c1CCC(CO)C2
InChIInChI=1S/C9H14N2O/c1-6-8-3-2-7(5-12)4-9(8)11-10-6/h7,12H,2-5H2,1H3,(H,10,11)
InChIKeyJJVQAPLANNTIFJ-UHFFFAOYSA-N
XLogP0.82
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-butyl-N-ethoxy-6,6-dimethyl-5,7-dihydroindazol-4-amine
CID 135569083
6,6-Dimethyl-3-propyl-1,5,6,7-tetrahydro-indazol-4-one O-ethyl-oxime
CID 135403078
(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanol
CID 21787796
4-Hydroxybutyl-3,5-bis-(tetrafluoroethyl)pyrazole
CID 129877153
cis-(1R,3S)-3-(3,5-dimethyl-1H-pyrazol-4-yl)cyclopentan-1-ol
CID 177823279
6-Methyl-3a,4,5,7-tetrahydro-3h-isoxazolo[4,3-g]indazole
CID 85986323
4,5,6,7-Tetrahydro-5-hydroxy-3-trifluoromethyl-1H-indazole
CID 57368453
(4-fluoro-4,5,6,7-tetrahydro-1H-indazol-3-yl)methanol
CID 105434428
(4-Fluoro-4-methyl-1,5,6,7-tetrahydroindazol-3-yl)methanol
CID 105441104
2-(5-cyclobutyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)ethan-1-ol
CID 121213245
2-(5-cyclopentyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)ethan-1-ol
CID 121213246
2-[(7-fluoro-4,5-dihydro-2H-indazol-3-yl)methyl]pentan-1-ol
CID 143749682

Frequently Asked Questions

What is the IUPAC name of (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol?
The IUPAC name of (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol (CID 123200606) is (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol.
What is the SMILES notation for (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol?
The canonical SMILES for (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol is Cc1[nH]nc2c1CCC(CO)C2.
What is the InChIKey of (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol?
The InChIKey is JJVQAPLANNTIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-6-8-3-2-7(5-12)4-9(8)11-10-6/h7,12H,2-5H2,1H3,(H,10,11).
What are the key properties of (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol?
(3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol has a molecular weight of 166.22 g/mol, XLogP of 0.82, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-yl)methanol is sourced from PubChem (CID 123200606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).