3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide

C19H13F3N2O3 — CID 55713821

IUPAC3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide
SMILESO=C(Nc1ccc(Oc2ccc(F)cc2)nc1)c1cccc(OC(F)F)c1
InChIInChI=1S/C19H13F3N2O3/c20-13-4-7-15(8-5-13)26-17-9-6-14(11-23-17)24-18(25)12-2-1-3-16(10-12)27-19(21)22/h1-11,19H,(H,24,25)
InChIKeyLWDXGBIFRDGPHJ-UHFFFAOYSA-N
MW374.32 g/mol
LogP4.87
Rot. Bonds6

About 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide

3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide (PubChem CID 55713821) has the molecular formula C19H13F3N2O3 and a molecular weight of 374.32 g/mol. Its IUPAC name is 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide.

Molecular Properties

Compound Name3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide
PubChem CID55713821
Molecular FormulaC19H13F3N2O3
Molecular Weight374.32 g/mol
Exact Mass374.09
IUPAC Name3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide
SMILESO=C(Nc1ccc(Oc2ccc(F)cc2)nc1)c1cccc(OC(F)F)c1
InChIInChI=1S/C19H13F3N2O3/c20-13-4-7-15(8-5-13)26-17-9-6-14(11-23-17)24-18(25)12-2-1-3-16(10-12)27-19(21)22/h1-11,19H,(H,24,25)
InChIKeyLWDXGBIFRDGPHJ-UHFFFAOYSA-N
XLogP4.87
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.32
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(difluoromethoxy)-N-(6-fluoro-3-pyridinyl)benzamide
CID 103789754
3-(difluoromethoxy)-N-[4-(4-methylphenoxy)phenyl]benzamide
CID 7925214
3-(difluoromethoxy)-N-[4-(4-ethoxyphenoxy)phenyl]benzamide
CID 7925305
N-(4-acetamidophenyl)-3-(difluoromethoxy)benzamide
CID 2583008
4-bromo-N-[6-(4-fluorophenoxy)-3-pyridinyl]-3,5-dimethoxybenzamide
CID 55713973
1-N-(6-phenoxy-3-pyridinyl)-3-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)benzene-1,3-dicarboxamide
CID 67006872
3-(4-fluorophenoxy)-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]benzamide
CID 122307912
3-N-(4-fluorophenyl)-1-N-(4-propan-2-yloxyphenyl)benzene-1,3-dicarboxamide
CID 109057469
(2S)-2-bromo-N-[6-(4-fluorophenoxy)-3-pyridinyl]propanamide
CID 6930724
3-[[3-(difluoromethoxy)benzoyl]amino]-1H-pyrazole-5-carboxylic acid
CID 64526280
3-[2-(cyclopropylmethylamino)cyclopropyl]-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide;bis(2,2,2-trifluoroacetic acid)
CID 118304774
3-(difluoromethoxy)-N-[4-(2-hydroxyethyl)phenyl]benzamide
CID 110902273

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide?
The IUPAC name of 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide (CID 55713821) is 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide.
What is the SMILES notation for 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide?
The canonical SMILES for 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide is O=C(Nc1ccc(Oc2ccc(F)cc2)nc1)c1cccc(OC(F)F)c1.
What is the InChIKey of 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide?
The InChIKey is LWDXGBIFRDGPHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F3N2O3/c20-13-4-7-15(8-5-13)26-17-9-6-14(11-23-17)24-18(25)12-2-1-3-16(10-12)27-19(21)22/h1-11,19H,(H,24,25).
What are the key properties of 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide?
3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide has a molecular weight of 374.32 g/mol, XLogP of 4.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxy)-N-[6-(4-fluorophenoxy)-3-pyridinyl]benzamide is sourced from PubChem (CID 55713821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).