2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine

C12H11N5O — CID 141485782

IUPAC2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine
SMILESc1cnc2nc(-c3cnn(C4COC4)c3)[nH]c2c1
InChIInChI=1S/C12H11N5O/c1-2-10-12(13-3-1)16-11(15-10)8-4-14-17(5-8)9-6-18-7-9/h1-5,9H,6-7H2,(H,13,15,16)
InChIKeyYSVVTZHYGCOQBA-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.39
Rot. Bonds2

About 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine

2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine (PubChem CID 141485782) has the molecular formula C12H11N5O and a molecular weight of 241.25 g/mol. Its IUPAC name is 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine
PubChem CID141485782
Molecular FormulaC12H11N5O
Molecular Weight241.25 g/mol
Exact Mass241.10
IUPAC Name2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine
SMILESc1cnc2nc(-c3cnn(C4COC4)c3)[nH]c2c1
InChIInChI=1S/C12H11N5O/c1-2-10-12(13-3-1)16-11(15-10)8-4-14-17(5-8)9-6-18-7-9/h1-5,9H,6-7H2,(H,13,15,16)
InChIKeyYSVVTZHYGCOQBA-UHFFFAOYSA-N
XLogP1.39
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-(2-methoxyphenyl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine
CID 59784478
4-(4-methylphenyl)-1-(oxetan-3-yl)pyrazole
CID 167820480
5-(1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
CID 63259845
3-(1H-imidazo[4,5-b]pyridin-2-yl)-5-(1-methylpyrazol-4-yl)-2H-pyrazolo[3,4-b]pyridine
CID 137056909
4-(1H-imidazo[4,5-b]pyridin-2-yl)benzonitrile
CID 838912
2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 104786090
2-(2,3-dihydro-1H-isoindol-5-yl)-1H-imidazo[4,5-b]pyridine
CID 103997607
[2-fluoro-4-[2-[1-(oxan-4-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]methanamine
CID 121249907
2-chloro-5-fluoro-4-[1-(oxetan-3-yl)pyrazol-4-yl]pyrimidine
CID 171627470
CID 59368109
CID 59368109
2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine
CID 14369059
2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 104639107

Frequently Asked Questions

What is the IUPAC name of 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine (CID 141485782) is 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine is c1cnc2nc(-c3cnn(C4COC4)c3)[nH]c2c1.
What is the InChIKey of 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is YSVVTZHYGCOQBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O/c1-2-10-12(13-3-1)16-11(15-10)8-4-14-17(5-8)9-6-18-7-9/h1-5,9H,6-7H2,(H,13,15,16).
What are the key properties of 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine?
2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 241.25 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(oxetan-3-yl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 141485782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).