(5-amino-2-methylindazol-6-yl)methanol

C9H11N3O — CID 176566592

IUPAC(5-amino-2-methylindazol-6-yl)methanol
SMILESCn1cc2cc(N)c(CO)cc2n1
InChIInChI=1S/C9H11N3O/c1-12-4-6-2-8(10)7(5-13)3-9(6)11-12/h2-4,13H,5,10H2,1H3
InChIKeySDLBHIRAYDMOHZ-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.65
Rot. Bonds1

About (5-amino-2-methylindazol-6-yl)methanol

(5-amino-2-methylindazol-6-yl)methanol (PubChem CID 176566592) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is (5-amino-2-methylindazol-6-yl)methanol.

Molecular Properties

Compound Name(5-amino-2-methylindazol-6-yl)methanol
PubChem CID176566592
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name(5-amino-2-methylindazol-6-yl)methanol
SMILESCn1cc2cc(N)c(CO)cc2n1
InChIInChI=1S/C9H11N3O/c1-12-4-6-2-8(10)7(5-13)3-9(6)11-12/h2-4,13H,5,10H2,1H3
InChIKeySDLBHIRAYDMOHZ-UHFFFAOYSA-N
XLogP0.65
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(2,5-dimethylindazol-6-yl)methanol;ethane
CID 176566676
6-fluoro-2-methylindazol-5-amine
CID 118626680
5-fluoro-2-methylindazol-6-amine
CID 117110292
6-cyclopropyl-2-methylindazol-5-amine
CID 118226516
ethane;2-methylindazol-6-amine
CID 178017314
2-methylindazol-6-amine;dihydrochloride
CID 19354431
2,6-dimethyl-5-propylindazole
CID 177040666
3-(5-amino-6-methoxyindazol-2-yl)propan-1-ol
CID 129283930
6-chloro-2,5-dimethylindazole
CID 171662405
ethyl 2-(2-methylindazol-5-yl)acetate
CID 155343728
[5-(2-methylindazol-5-yl)-1,2-oxazol-3-yl]methanol
CID 151597822
2-methylindazole-5-carbothioamide
CID 83445998

Frequently Asked Questions

What is the IUPAC name of (5-amino-2-methylindazol-6-yl)methanol?
The IUPAC name of (5-amino-2-methylindazol-6-yl)methanol (CID 176566592) is (5-amino-2-methylindazol-6-yl)methanol.
What is the SMILES notation for (5-amino-2-methylindazol-6-yl)methanol?
The canonical SMILES for (5-amino-2-methylindazol-6-yl)methanol is Cn1cc2cc(N)c(CO)cc2n1.
What is the InChIKey of (5-amino-2-methylindazol-6-yl)methanol?
The InChIKey is SDLBHIRAYDMOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-12-4-6-2-8(10)7(5-13)3-9(6)11-12/h2-4,13H,5,10H2,1H3.
What are the key properties of (5-amino-2-methylindazol-6-yl)methanol?
(5-amino-2-methylindazol-6-yl)methanol has a molecular weight of 177.21 g/mol, XLogP of 0.65, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-2-methylindazol-6-yl)methanol is sourced from PubChem (CID 176566592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).