1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine

C9H15N3 — CID 82586328

IUPAC1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
SMILESCC(C)n1ncc2c1CCNC2
InChIInChI=1S/C9H15N3/c1-7(2)12-9-3-4-10-5-8(9)6-11-12/h6-7,10H,3-5H2,1-2H3
InChIKeyKZSZNEHSOBRKEK-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.11
Rot. Bonds1

About 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine

1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine (PubChem CID 82586328) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine.

Molecular Properties

Compound Name1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
PubChem CID82586328
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
SMILESCC(C)n1ncc2c1CCNC2
InChIInChI=1S/C9H15N3/c1-7(2)12-9-3-4-10-5-8(9)6-11-12/h6-7,10H,3-5H2,1-2H3
InChIKeyKZSZNEHSOBRKEK-UHFFFAOYSA-N
XLogP1.11
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The IUPAC name of 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine (CID 82586328) is 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine.
What is the SMILES notation for 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The canonical SMILES for 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine is CC(C)n1ncc2c1CCNC2.
What is the InChIKey of 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The InChIKey is KZSZNEHSOBRKEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-7(2)12-9-3-4-10-5-8(9)6-11-12/h6-7,10H,3-5H2,1-2H3.
What are the key properties of 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine?
1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine has a molecular weight of 165.24 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine is sourced from PubChem (CID 82586328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).