4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine

C11H13N3O — CID 59618953

IUPAC4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine
SMILESCc1[nH]nc2ccnc(OC3CCC3)c12
InChIInChI=1S/C11H13N3O/c1-7-10-9(14-13-7)5-6-12-11(10)15-8-3-2-4-8/h5-6,8H,2-4H2,1H3,(H,13,14)
InChIKeyCQHYLMYNXDBBAC-UHFFFAOYSA-N
MW203.25 g/mol
LogP2.20
Rot. Bonds2

About 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine

4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine (PubChem CID 59618953) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine
PubChem CID59618953
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine
SMILESCc1[nH]nc2ccnc(OC3CCC3)c12
InChIInChI=1S/C11H13N3O/c1-7-10-9(14-13-7)5-6-12-11(10)15-8-3-2-4-8/h5-6,8H,2-4H2,1H3,(H,13,14)
InChIKeyCQHYLMYNXDBBAC-UHFFFAOYSA-N
XLogP2.20
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine (CID 59618953) is 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine is Cc1[nH]nc2ccnc(OC3CCC3)c12.
What is the InChIKey of 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine?
The InChIKey is CQHYLMYNXDBBAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-7-10-9(14-13-7)5-6-12-11(10)15-8-3-2-4-8/h5-6,8H,2-4H2,1H3,(H,13,14).
What are the key properties of 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine?
4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine has a molecular weight of 203.25 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyloxy-3-methyl-2H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 59618953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).