2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole

C14H16N4 — CID 163632237

IUPAC2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole
SMILESCC(C)(C)c1cn2c(n1)CC(c1ccccn1)=N2
InChIInChI=1S/C14H16N4/c1-14(2,3)12-9-18-13(16-12)8-11(17-18)10-6-4-5-7-15-10/h4-7,9H,8H2,1-3H3
InChIKeyRXNQHTGSXCKJFK-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.38
Rot. Bonds1

About 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole

2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole (PubChem CID 163632237) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole.

Molecular Properties

Compound Name2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole
PubChem CID163632237
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC Name2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole
SMILESCC(C)(C)c1cn2c(n1)CC(c1ccccn1)=N2
InChIInChI=1S/C14H16N4/c1-14(2,3)12-9-18-13(16-12)8-11(17-18)10-6-4-5-7-15-10/h4-7,9H,8H2,1-3H3
InChIKeyRXNQHTGSXCKJFK-UHFFFAOYSA-N
XLogP2.38
TPSA43.07 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 114763827
2-(5-pyridin-2-yl-4H-pyrazol-3-yl)pyridine
CID 58175901
4-tert-butyl-6-(4-methylpiperazin-1-yl)-2-pyridin-2-ylpyrimidine
CID 155901264
2-(2-tert-butylphenyl)pyridine
CID 67807360
2-(2H-azirin-3-yl)pyridine
CID 123655147
2-tert-butylpyridine;ethane;methane
CID 143332153
2,4,6-tripyridin-2-ylpyrimidine
CID 70005539
2-(6-pyridin-2-ylpyrimidin-4-yl)propan-2-amine
CID 83849094
CID 139150015
CID 139150015
2-(4-tert-butylnaphthalen-1-yl)pyridine
CID 171748905
2-(6-tert-butyl-2-pyridinyl)pyrimidine
CID 166590913
cobalt;ethane;tris(2-pyridin-2-ylpyridine)
CID 161013986

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole?
The IUPAC name of 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole (CID 163632237) is 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole.
What is the SMILES notation for 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole?
The canonical SMILES for 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole is CC(C)(C)c1cn2c(n1)CC(c1ccccn1)=N2.
What is the InChIKey of 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole?
The InChIKey is RXNQHTGSXCKJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c1-14(2,3)12-9-18-13(16-12)8-11(17-18)10-6-4-5-7-15-10/h4-7,9H,8H2,1-3H3.
What are the key properties of 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole?
2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole has a molecular weight of 240.31 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-pyridin-2-yl-7H-imidazo[1,2-b]pyrazole is sourced from PubChem (CID 163632237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).