2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine

C12H14F2N2O — CID 141352093

IUPAC2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine
SMILESFC1(F)CN(c2cccnc2OCC2CC2)C1
InChIInChI=1S/C12H14F2N2O/c13-12(14)7-16(8-12)10-2-1-5-15-11(10)17-6-9-3-4-9/h1-2,5,9H,3-4,6-8H2
InChIKeyYGRIUTQJWXQOFQ-UHFFFAOYSA-N
MW240.25 g/mol
LogP2.33
Rot. Bonds4

About 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine

2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine (PubChem CID 141352093) has the molecular formula C12H14F2N2O and a molecular weight of 240.25 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine
PubChem CID141352093
Molecular FormulaC12H14F2N2O
Molecular Weight240.25 g/mol
Exact Mass240.11
IUPAC Name2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine
SMILESFC1(F)CN(c2cccnc2OCC2CC2)C1
InChIInChI=1S/C12H14F2N2O/c13-12(14)7-16(8-12)10-2-1-5-15-11(10)17-6-9-3-4-9/h1-2,5,9H,3-4,6-8H2
InChIKeyYGRIUTQJWXQOFQ-UHFFFAOYSA-N
XLogP2.33
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.25
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-cyclopropyl-3-fluoroazetidin-1-yl)-2-(cyclopropylmethoxy)pyridine
CID 151630741
[4-(2-amino-2-oxoethyl)piperidin-4-yl]azanide;2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine
CID 159393533
6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 71105626
1-[[6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)-2-pyridinyl]-hydroxymethyl]-3-methylpyrrolidin-3-ol
CID 130312698
1-[6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)-2-pyridinyl]-2-[(3-methyl-1-pyrimidin-2-ylbutyl)amino]ethanone
CID 163807528
2-(cyclopropylmethoxy)-3-propan-2-ylpyridine
CID 164786458
1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl-[6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)-2-pyridinyl]methanone
CID 123443174
[6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)-2-pyridinyl]-(2-thia-6-azaspiro[3.3]heptan-6-yl)methanone
CID 144638507
[6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)-2-pyridinyl]-[(4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]methanone
CID 118451444
1-tert-butyl-1,3,3-trimethylurea;6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)pyridine-2-carboxylic acid
CID 90204423
1-[6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)pyridine-2-carbonyl]-4-methylpyrrolidine-3-carboxylic acid
CID 130312677
N-(2-amino-2-oxoethyl)-N-tert-butyl-6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)pyridine-2-carboxamide
CID 90204589

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine?
The IUPAC name of 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine (CID 141352093) is 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine?
The canonical SMILES for 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine is FC1(F)CN(c2cccnc2OCC2CC2)C1.
What is the InChIKey of 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine?
The InChIKey is YGRIUTQJWXQOFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F2N2O/c13-12(14)7-16(8-12)10-2-1-5-15-11(10)17-6-9-3-4-9/h1-2,5,9H,3-4,6-8H2.
What are the key properties of 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine?
2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine has a molecular weight of 240.25 g/mol, XLogP of 2.33, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-3-(3,3-difluoroazetidin-1-yl)pyridine is sourced from PubChem (CID 141352093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).