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

C10H17N3 — CID 82586429

IUPAC3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
SMILESCc1nn(C(C)C)c2c1CNCC2
InChIInChI=1S/C10H17N3/c1-7(2)13-10-4-5-11-6-9(10)8(3)12-13/h7,11H,4-6H2,1-3H3
InChIKeyQJNFNQMJBYELJB-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.42
Rot. Bonds1

About 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine

3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine (PubChem CID 82586429) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine.

Molecular Properties

Compound Name3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
PubChem CID82586429
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
SMILESCc1nn(C(C)C)c2c1CNCC2
InChIInChI=1S/C10H17N3/c1-7(2)13-10-4-5-11-6-9(10)8(3)12-13/h7,11H,4-6H2,1-3H3
InChIKeyQJNFNQMJBYELJB-UHFFFAOYSA-N
XLogP1.42
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The IUPAC name of 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine (CID 82586429) is 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine.
What is the SMILES notation for 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The canonical SMILES for 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine is Cc1nn(C(C)C)c2c1CNCC2.
What is the InChIKey of 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The InChIKey is QJNFNQMJBYELJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-7(2)13-10-4-5-11-6-9(10)8(3)12-13/h7,11H,4-6H2,1-3H3.
What are the key properties of 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine?
3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine has a molecular weight of 179.27 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine is sourced from PubChem (CID 82586429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).