2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine

C12H13N3O — CID 134515476

IUPAC2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine
SMILESCc1cccc(-c2ccn(C3COC3)n2)n1
InChIInChI=1S/C12H13N3O/c1-9-3-2-4-11(13-9)12-5-6-15(14-12)10-7-16-8-10/h2-6,10H,7-8H2,1H3
InChIKeyNXONPTWKBNGZIH-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.82
Rot. Bonds2

About 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine

2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine (PubChem CID 134515476) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine.

Molecular Properties

Compound Name2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine
PubChem CID134515476
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine
SMILESCc1cccc(-c2ccn(C3COC3)n2)n1
InChIInChI=1S/C12H13N3O/c1-9-3-2-4-11(13-9)12-5-6-15(14-12)10-7-16-8-10/h2-6,10H,7-8H2,1H3
InChIKeyNXONPTWKBNGZIH-UHFFFAOYSA-N
XLogP1.82
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-bromo-1-(oxolan-3-yl)pyrazol-3-yl]-6-methylpyridine
CID 139505146
3-iodo-1-(oxetan-3-yl)pyrazole
CID 67342544
3-(difluoromethyl)-1-(oxetan-3-yl)pyrazole
CID 156818624
(3S)-4-(3-methylpyrazol-1-yl)oxolan-3-ol
CID 126672443
ethyl 6-[1-(oxetan-3-yl)pyrazol-3-yl]triazolo[1,5-a]pyridine-3-carboxylate
CID 170633698
7-methyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine
CID 152667563
2-methyl-5,6-bis(6-methyl-2-pyridinyl)-2,3-dihydropyrazine
CID 71325625
2-methyl-6-(6-phenyl-2-pyridinyl)pyridine
CID 14698682
bis(3,6-bis(6-methyl-2-pyridinyl)pyridazine);chloronickel
CID 87631405
2-methyl-6-[6-[2-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]ethyl]-2-pyridinyl]pyridine
CID 14148604
5,6-bis(6-methyl-2-pyridinyl)-2,3-dihydropyrazine
CID 71357819
3,6-bis(6-methyl-2-pyridinyl)pyridazine;chlorocopper
CID 69390667

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine?
The IUPAC name of 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine (CID 134515476) is 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine.
What is the SMILES notation for 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine?
The canonical SMILES for 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine is Cc1cccc(-c2ccn(C3COC3)n2)n1.
What is the InChIKey of 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine?
The InChIKey is NXONPTWKBNGZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c1-9-3-2-4-11(13-9)12-5-6-15(14-12)10-7-16-8-10/h2-6,10H,7-8H2,1H3.
What are the key properties of 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine?
2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine has a molecular weight of 215.26 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[1-(oxetan-3-yl)pyrazol-3-yl]pyridine is sourced from PubChem (CID 134515476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).