(5-chloro-1-methylindazol-7-yl)methanol

C9H9ClN2O — CID 90418573

IUPAC(5-chloro-1-methylindazol-7-yl)methanol
SMILESCn1ncc2cc(Cl)cc(CO)c21
InChIInChI=1S/C9H9ClN2O/c1-12-9-6(4-11-12)2-8(10)3-7(9)5-13/h2-4,13H,5H2,1H3
InChIKeyZBTAHPZVNQNPCR-UHFFFAOYSA-N
MW196.64 g/mol
LogP1.72
Rot. Bonds1

About (5-chloro-1-methylindazol-7-yl)methanol

(5-chloro-1-methylindazol-7-yl)methanol (PubChem CID 90418573) has the molecular formula C9H9ClN2O and a molecular weight of 196.64 g/mol. Its IUPAC name is (5-chloro-1-methylindazol-7-yl)methanol.

Molecular Properties

Compound Name(5-chloro-1-methylindazol-7-yl)methanol
PubChem CID90418573
Molecular FormulaC9H9ClN2O
Molecular Weight196.64 g/mol
Exact Mass196.04
IUPAC Name(5-chloro-1-methylindazol-7-yl)methanol
SMILESCn1ncc2cc(Cl)cc(CO)c21
InChIInChI=1S/C9H9ClN2O/c1-12-9-6(4-11-12)2-8(10)3-7(9)5-13/h2-4,13H,5H2,1H3
InChIKeyZBTAHPZVNQNPCR-UHFFFAOYSA-N
XLogP1.72
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.64
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5-chloro-1-methylindazol-7-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5-chloro-1-methylindazol-7-yl)methanol?
The IUPAC name of (5-chloro-1-methylindazol-7-yl)methanol (CID 90418573) is (5-chloro-1-methylindazol-7-yl)methanol.
What is the SMILES notation for (5-chloro-1-methylindazol-7-yl)methanol?
The canonical SMILES for (5-chloro-1-methylindazol-7-yl)methanol is Cn1ncc2cc(Cl)cc(CO)c21.
What is the InChIKey of (5-chloro-1-methylindazol-7-yl)methanol?
The InChIKey is ZBTAHPZVNQNPCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN2O/c1-12-9-6(4-11-12)2-8(10)3-7(9)5-13/h2-4,13H,5H2,1H3.
What are the key properties of (5-chloro-1-methylindazol-7-yl)methanol?
(5-chloro-1-methylindazol-7-yl)methanol has a molecular weight of 196.64 g/mol, XLogP of 1.72, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1-methylindazol-7-yl)methanol is sourced from PubChem (CID 90418573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).