3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine

C15H17N3 — CID 84647348

IUPAC3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine
SMILESc1ccc(-n2nc(C3CC3)c3c2CCCN3)cc1
InChIInChI=1S/C15H17N3/c1-2-5-12(6-3-1)18-13-7-4-10-16-15(13)14(17-18)11-8-9-11/h1-3,5-6,11,16H,4,7-10H2
InChIKeyIKEASJRBLKHPOT-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.11
Rot. Bonds2

About 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine

3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine (PubChem CID 84647348) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine
PubChem CID84647348
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine
SMILESc1ccc(-n2nc(C3CC3)c3c2CCCN3)cc1
InChIInChI=1S/C15H17N3/c1-2-5-12(6-3-1)18-13-7-4-10-16-15(13)14(17-18)11-8-9-11/h1-3,5-6,11,16H,4,7-10H2
InChIKeyIKEASJRBLKHPOT-UHFFFAOYSA-N
XLogP3.11
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine?
The IUPAC name of 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine (CID 84647348) is 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine.
What is the SMILES notation for 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine?
The canonical SMILES for 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine is c1ccc(-n2nc(C3CC3)c3c2CCCN3)cc1.
What is the InChIKey of 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine?
The InChIKey is IKEASJRBLKHPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-2-5-12(6-3-1)18-13-7-4-10-16-15(13)14(17-18)11-8-9-11/h1-3,5-6,11,16H,4,7-10H2.
What are the key properties of 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine?
3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine has a molecular weight of 239.32 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-phenyl-4,5,6,7-tetrahydropyrazolo[4,3-b]pyridine is sourced from PubChem (CID 84647348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).