[2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone

C13H9F2NO3 — CID 134621157

IUPAC[2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone
SMILESO=C(c1cccnc1)c1c(O)cccc1OC(F)F
InChIInChI=1S/C13H9F2NO3/c14-13(15)19-10-5-1-4-9(17)11(10)12(18)8-3-2-6-16-7-8/h1-7,13,17H
InChIKeyYVVDEPGNGCHPAW-UHFFFAOYSA-N
MW265.22 g/mol
LogP2.62
Rot. Bonds4

About [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone

[2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone (PubChem CID 134621157) has the molecular formula C13H9F2NO3 and a molecular weight of 265.22 g/mol. Its IUPAC name is [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone.

Molecular Properties

Compound Name[2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone
PubChem CID134621157
Molecular FormulaC13H9F2NO3
Molecular Weight265.22 g/mol
Exact Mass265.06
IUPAC Name[2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone
SMILESO=C(c1cccnc1)c1c(O)cccc1OC(F)F
InChIInChI=1S/C13H9F2NO3/c14-13(15)19-10-5-1-4-9(17)11(10)12(18)8-3-2-6-16-7-8/h1-7,13,17H
InChIKeyYVVDEPGNGCHPAW-UHFFFAOYSA-N
XLogP2.62
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.22
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(difluoromethoxy)-6-nitrophenyl]-pyridin-3-ylmethanone
CID 134621166
[2-chloro-3-(difluoromethoxy)phenyl]-pyridin-3-ylmethanone
CID 134621435
[3-(difluoromethoxy)phenyl]-pyridin-3-ylmethanone
CID 114963185
[4-amino-2-(difluoromethoxy)phenyl]-pyridin-3-ylmethanone
CID 134622086
N-[2,3-bis(difluoromethoxy)phenyl]-N-phenylpyridine-3-carboxamide
CID 141089286
(2,6-dichlorophenyl)-pyridin-3-ylmethanone
CID 14249700
(4-fluorophenyl)-pyridin-3-ylmethanone
CID 762660
2-[4-(difluoromethoxy)phenoxy]-1-pyridin-3-ylpentan-1-one
CID 86157460
2-acetyl-3-(difluoromethoxy)benzaldehyde
CID 170996257
(2-methoxyphenyl)-pyridin-3-ylmethanone
CID 18357321
N-[1-[4-(difluoromethoxy)phenyl]ethylideneamino]pyridine-3-carboxamide
CID 4606175
2,2-diamino-1-pyridin-3-ylethanone
CID 174594045

Frequently Asked Questions

What is the IUPAC name of [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone?
The IUPAC name of [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone (CID 134621157) is [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone.
What is the SMILES notation for [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone?
The canonical SMILES for [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone is O=C(c1cccnc1)c1c(O)cccc1OC(F)F.
What is the InChIKey of [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone?
The InChIKey is YVVDEPGNGCHPAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2NO3/c14-13(15)19-10-5-1-4-9(17)11(10)12(18)8-3-2-6-16-7-8/h1-7,13,17H.
What are the key properties of [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone?
[2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone has a molecular weight of 265.22 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(difluoromethoxy)-6-hydroxyphenyl]-pyridin-3-ylmethanone is sourced from PubChem (CID 134621157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).