(6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol

C9H10ClN3O — CID 82036391

IUPAC(6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol
SMILESCc1nn(C)c2nc(Cl)c(CO)cc12
InChIInChI=1S/C9H10ClN3O/c1-5-7-3-6(4-14)8(10)11-9(7)13(2)12-5/h3,14H,4H2,1-2H3
InChIKeyHMYYWQYUWHMSLV-UHFFFAOYSA-N
MW211.65 g/mol
LogP1.42
Rot. Bonds1

About (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol

(6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol (PubChem CID 82036391) has the molecular formula C9H10ClN3O and a molecular weight of 211.65 g/mol. Its IUPAC name is (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol.

Molecular Properties

Compound Name(6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol
PubChem CID82036391
Molecular FormulaC9H10ClN3O
Molecular Weight211.65 g/mol
Exact Mass211.05
IUPAC Name(6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol
SMILESCc1nn(C)c2nc(Cl)c(CO)cc12
InChIInChI=1S/C9H10ClN3O/c1-5-7-3-6(4-14)8(10)11-9(7)13(2)12-5/h3,14H,4H2,1-2H3
InChIKeyHMYYWQYUWHMSLV-UHFFFAOYSA-N
XLogP1.42
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-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 (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol?
The IUPAC name of (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol (CID 82036391) is (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol.
What is the SMILES notation for (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol?
The canonical SMILES for (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol is Cc1nn(C)c2nc(Cl)c(CO)cc12.
What is the InChIKey of (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol?
The InChIKey is HMYYWQYUWHMSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3O/c1-5-7-3-6(4-14)8(10)11-9(7)13(2)12-5/h3,14H,4H2,1-2H3.
What are the key properties of (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol?
(6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol has a molecular weight of 211.65 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methanol is sourced from PubChem (CID 82036391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).