5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

C13H22N2 — CID 170772080

IUPAC5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILESCC(C)C1Cc2ccnn2CC1C(C)C
InChIInChI=1S/C13H22N2/c1-9(2)12-7-11-5-6-14-15(11)8-13(12)10(3)4/h5-6,9-10,12-13H,7-8H2,1-4H3
InChIKeyHCJYOXVTEFOFQD-UHFFFAOYSA-N
MW206.33 g/mol
LogP2.98
Rot. Bonds2

About 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (PubChem CID 170772080) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
PubChem CID170772080
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILESCC(C)C1Cc2ccnn2CC1C(C)C
InChIInChI=1S/C13H22N2/c1-9(2)12-7-11-5-6-14-15(11)8-13(12)10(3)4/h5-6,9-10,12-13H,7-8H2,1-4H3
InChIKeyHCJYOXVTEFOFQD-UHFFFAOYSA-N
XLogP2.98
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-1-[(6R)-6-propan-2-yl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]prop-2-en-1-one
CID 166430879
6-ethyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 170078658
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-amine
CID 55284769
5-(1-methylsulfanylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 155464321
5-benzyl-6-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 162422052
1-(5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-5-yl)-1,3-diazinane-2,4-dione
CID 166036221
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde
CID 83872460
2,3-di(propan-2-yl)-1,2,3,4-tetrahydronaphthalene
CID 23532958
5-methyl-7-(2-pyrrolidin-1-ylethyl)-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine
CID 133137726
5-acetyl-N-[2-(dimethylamino)ethyl]-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-7-carboxamide
CID 134069108
5-methyl-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine
CID 123852001
N-cyclobutyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-amine
CID 121185160

Frequently Asked Questions

What is the IUPAC name of 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The IUPAC name of 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (CID 170772080) is 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is CC(C)C1Cc2ccnn2CC1C(C)C.
What is the InChIKey of 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The InChIKey is HCJYOXVTEFOFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-9(2)12-7-11-5-6-14-15(11)8-13(12)10(3)4/h5-6,9-10,12-13H,7-8H2,1-4H3.
What are the key properties of 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine has a molecular weight of 206.33 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-di(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 170772080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).