2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine

C9H10F2N2O — CID 175648008

IUPAC2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine
SMILESCOc1cccnc1N1CC(F)(F)C1
InChIInChI=1S/C9H10F2N2O/c1-14-7-3-2-4-12-8(7)13-5-9(10,11)6-13/h2-4H,5-6H2,1H3
InChIKeyOFBPIGKVDCLQMF-UHFFFAOYSA-N
MW200.19 g/mol
LogP1.55
Rot. Bonds2

About 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine

2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine (PubChem CID 175648008) has the molecular formula C9H10F2N2O and a molecular weight of 200.19 g/mol. Its IUPAC name is 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine.

Molecular Properties

Compound Name2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine
PubChem CID175648008
Molecular FormulaC9H10F2N2O
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine
SMILESCOc1cccnc1N1CC(F)(F)C1
InChIInChI=1S/C9H10F2N2O/c1-14-7-3-2-4-12-8(7)13-5-9(10,11)6-13/h2-4H,5-6H2,1H3
InChIKeyOFBPIGKVDCLQMF-UHFFFAOYSA-N
XLogP1.55
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-2-(4-methylpiperidin-1-yl)pyridine
CID 155975394
3-methoxy-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine
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1-(3-methoxy-2-pyridinyl)-4-methylazepan-4-ol
CID 107407374
1-[4-(3-methoxy-2-pyridinyl)piperazin-1-yl]ethanone
CID 176933932
1-(2-chlorophenyl)-4-(3-methoxy-2-pyridinyl)piperazine
CID 171335865
2,2-diethyl-4-(3-methoxy-2-pyridinyl)-1,4-thiazinane 1,1-dioxide
CID 167751727
tert-butyl 4-(3-methoxy-2-pyridinyl)piperazine-1-carboxylate
CID 70571171
3-methoxy-2-(4-methylimidazol-1-yl)pyridine
CID 141128975
3-ethyl-1-(3-propan-2-yloxy-2-pyridinyl)azetidin-3-amine
CID 113371377
1-(3-methoxy-2-pyridinyl)azet-2-one
CID 175088314
2-(chloromethyl)-4-(3-methoxy-2-pyridinyl)-6-methylmorpholine
CID 102937094
N-tert-butyl-1-(3-methoxy-2-pyridinyl)pyrrolidine-3-carboxamide
CID 172899385

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine?
The IUPAC name of 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine (CID 175648008) is 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine.
What is the SMILES notation for 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine?
The canonical SMILES for 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine is COc1cccnc1N1CC(F)(F)C1.
What is the InChIKey of 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine?
The InChIKey is OFBPIGKVDCLQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O/c1-14-7-3-2-4-12-8(7)13-5-9(10,11)6-13/h2-4H,5-6H2,1H3.
What are the key properties of 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine?
2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine has a molecular weight of 200.19 g/mol, XLogP of 1.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-difluoroazetidin-1-yl)-3-methoxypyridine is sourced from PubChem (CID 175648008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).