2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine

C10H18N2 — CID 166647551

IUPAC2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine
SMILESCC(C)C1C=C2CCCCN2N1
InChIInChI=1S/C10H18N2/c1-8(2)10-7-9-5-3-4-6-12(9)11-10/h7-8,10-11H,3-6H2,1-2H3
InChIKeyQJMMKWDWWYOZSR-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.90
Rot. Bonds1

About 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine

2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine (PubChem CID 166647551) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine
PubChem CID166647551
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine
SMILESCC(C)C1C=C2CCCCN2N1
InChIInChI=1S/C10H18N2/c1-8(2)10-7-9-5-3-4-6-12(9)11-10/h7-8,10-11H,3-6H2,1-2H3
InChIKeyQJMMKWDWWYOZSR-UHFFFAOYSA-N
XLogP1.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine?
The IUPAC name of 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine (CID 166647551) is 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine is CC(C)C1C=C2CCCCN2N1.
What is the InChIKey of 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine?
The InChIKey is QJMMKWDWWYOZSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-8(2)10-7-9-5-3-4-6-12(9)11-10/h7-8,10-11H,3-6H2,1-2H3.
What are the key properties of 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine?
2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine has a molecular weight of 166.27 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-1,2,4,5,6,7-hexahydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 166647551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).