4-(3,3-difluorocyclobutyl)oxypyridine

C9H9F2NO — CID 151538353

IUPAC4-(3,3-difluorocyclobutyl)oxypyridine
SMILESFC1(F)CC(Oc2ccncc2)C1
InChIInChI=1S/C9H9F2NO/c10-9(11)5-8(6-9)13-7-1-3-12-4-2-7/h1-4,8H,5-6H2
InChIKeyPXYFACWVNMXYLP-UHFFFAOYSA-N
MW185.17 g/mol
LogP2.26
Rot. Bonds2

About 4-(3,3-difluorocyclobutyl)oxypyridine

4-(3,3-difluorocyclobutyl)oxypyridine (PubChem CID 151538353) has the molecular formula C9H9F2NO and a molecular weight of 185.17 g/mol. Its IUPAC name is 4-(3,3-difluorocyclobutyl)oxypyridine.

Molecular Properties

Compound Name4-(3,3-difluorocyclobutyl)oxypyridine
PubChem CID151538353
Molecular FormulaC9H9F2NO
Molecular Weight185.17 g/mol
Exact Mass185.07
IUPAC Name4-(3,3-difluorocyclobutyl)oxypyridine
SMILESFC1(F)CC(Oc2ccncc2)C1
InChIInChI=1S/C9H9F2NO/c10-9(11)5-8(6-9)13-7-1-3-12-4-2-7/h1-4,8H,5-6H2
InChIKeyPXYFACWVNMXYLP-UHFFFAOYSA-N
XLogP2.26
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.17
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3,3-difluorocyclobutyl)oxypyridine?
The IUPAC name of 4-(3,3-difluorocyclobutyl)oxypyridine (CID 151538353) is 4-(3,3-difluorocyclobutyl)oxypyridine.
What is the SMILES notation for 4-(3,3-difluorocyclobutyl)oxypyridine?
The canonical SMILES for 4-(3,3-difluorocyclobutyl)oxypyridine is FC1(F)CC(Oc2ccncc2)C1.
What is the InChIKey of 4-(3,3-difluorocyclobutyl)oxypyridine?
The InChIKey is PXYFACWVNMXYLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F2NO/c10-9(11)5-8(6-9)13-7-1-3-12-4-2-7/h1-4,8H,5-6H2.
What are the key properties of 4-(3,3-difluorocyclobutyl)oxypyridine?
4-(3,3-difluorocyclobutyl)oxypyridine has a molecular weight of 185.17 g/mol, XLogP of 2.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,3-difluorocyclobutyl)oxypyridine is sourced from PubChem (CID 151538353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).