5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine

C9H8BrF2NO — CID 151835706

IUPAC5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine
SMILESFC1(F)CC(Oc2ccc(Br)cn2)C1
InChIInChI=1S/C9H8BrF2NO/c10-6-1-2-8(13-5-6)14-7-3-9(11,12)4-7/h1-2,5,7H,3-4H2
InChIKeySFPIRRQFOHWEKT-UHFFFAOYSA-N
MW264.07 g/mol
LogP3.02
Rot. Bonds2

About 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine

5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine (PubChem CID 151835706) has the molecular formula C9H8BrF2NO and a molecular weight of 264.07 g/mol. Its IUPAC name is 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine.

Molecular Properties

Compound Name5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine
PubChem CID151835706
Molecular FormulaC9H8BrF2NO
Molecular Weight264.07 g/mol
Exact Mass262.98
IUPAC Name5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine
SMILESFC1(F)CC(Oc2ccc(Br)cn2)C1
InChIInChI=1S/C9H8BrF2NO/c10-6-1-2-8(13-5-6)14-7-3-9(11,12)4-7/h1-2,5,7H,3-4H2
InChIKeySFPIRRQFOHWEKT-UHFFFAOYSA-N
XLogP3.02
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.07
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-2-(1-chloroazetidin-3-yl)oxypyridine
CID 88564773
1-bromo-4-(3,3-difluorocyclobutyl)oxybenzene
CID 118560278
5-bromo-2-[(3R)-pyrrolidin-3-yl]oxypyridine
CID 71303659
5-bromo-2-(3-methylcyclopentyl)oxypyridine
CID 67995994
2-(3,3-difluorocyclobutyl)oxy-5-propan-2-ylpyrazine
CID 177013978
5-bromo-2-[(3R)-piperidin-3-yl]oxypyridine
CID 71636380
5-bromo-2-piperidin-3-yloxypyridine;hydrochloride
CID 71636384
5-bromo-2-methoxypyridine
CID 2734895
2-(1-benzylpyrrolidin-3-yl)oxy-5-bromopyridine
CID 62918212
5-bromo-2-(1-cyclopropyl-2-fluoroethoxy)pyridine
CID 139415893
5-bromo-2-[(1-methylcyclopropyl)methoxy]pyridine
CID 97178675
5-bromo-2-(1-methoxyethoxy)pyridine
CID 69179526

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine?
The IUPAC name of 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine (CID 151835706) is 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine.
What is the SMILES notation for 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine?
The canonical SMILES for 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine is FC1(F)CC(Oc2ccc(Br)cn2)C1.
What is the InChIKey of 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine?
The InChIKey is SFPIRRQFOHWEKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrF2NO/c10-6-1-2-8(13-5-6)14-7-3-9(11,12)4-7/h1-2,5,7H,3-4H2.
What are the key properties of 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine?
5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine has a molecular weight of 264.07 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3,3-difluorocyclobutyl)oxypyridine is sourced from PubChem (CID 151835706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).