3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide

C19H10Cl3F3N2O3 — CID 10116535

IUPAC3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide
SMILESO=C(Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(Cl)c1)c1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C19H10Cl3F3N2O3/c20-10-5-12(17(28)14(22)6-10)18(29)27-11-2-3-15(13(21)7-11)30-16-4-1-9(8-26-16)19(23,24)25/h1-8,28H,(H,27,29)
InChIKeyPJDXOIZDILJMDI-UHFFFAOYSA-N
MW477.65 g/mol
LogP6.81
Rot. Bonds4

About 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide

3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide (PubChem CID 10116535) has the molecular formula C19H10Cl3F3N2O3 and a molecular weight of 477.65 g/mol. Its IUPAC name is 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide.

Molecular Properties

Compound Name3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide
PubChem CID10116535
Molecular FormulaC19H10Cl3F3N2O3
Molecular Weight477.65 g/mol
Exact Mass475.97
IUPAC Name3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide
SMILESO=C(Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(Cl)c1)c1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C19H10Cl3F3N2O3/c20-10-5-12(17(28)14(22)6-10)18(29)27-11-2-3-15(13(21)7-11)30-16-4-1-9(8-26-16)19(23,24)25/h1-8,28H,(H,27,29)
InChIKeyPJDXOIZDILJMDI-UHFFFAOYSA-N
XLogP6.81
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.65
LogP ≤ 56.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2,4-difluorobenzamide
CID 10113425
3-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]-3-oxopropanoate
CID 7084639
3,5-dichloro-N-[3-chloro-4-(3,5-dichlorophenoxy)phenyl]-2-hydroxybenzamide
CID 162650090
N-[4-[3,5-bis(trifluoromethyl)phenoxy]phenyl]-3,5-dichloro-2-hydroxybenzamide
CID 142662859
4-chloro-N-[3-chloro-4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-2-carboxamide
CID 73058486
N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-4-methylbenzamide
CID 40541033
2-[(2,4-dichlorobenzoyl)amino]-5-[[5-(trifluoromethyl)-2-pyridinyl]oxy]benzoate
CID 59060311
N-(3-bromo-4-phenoxyphenyl)-3,5-dichloro-2-hydroxybenzamide
CID 162656930
N-[3-chloro-4-[(5-chloro-2-pyridinyl)oxy]phenyl]-5-methylfuran-2-carboxamide
CID 73058458
2-fluoro-N-[6-[2-fluoro-4-(methylamino)phenoxy]-3-pyridinyl]-4-(trifluoromethyl)benzamide;hydrochloride
CID 56952843
6-[2-chloro-4-(trifluoromethyl)phenoxy]pyridine-3-sulfonamide
CID 70291084
2-[2-chloro-4-(trifluoromethoxy)phenoxy]-N-(6-fluoro-3-pyridinyl)-5-(trifluoromethyl)pyridine-3-carboxamide
CID 151376738

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide?
The IUPAC name of 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide (CID 10116535) is 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide.
What is the SMILES notation for 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide?
The canonical SMILES for 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide is O=C(Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(Cl)c1)c1cc(Cl)cc(Cl)c1O.
What is the InChIKey of 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide?
The InChIKey is PJDXOIZDILJMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H10Cl3F3N2O3/c20-10-5-12(17(28)14(22)6-10)18(29)27-11-2-3-15(13(21)7-11)30-16-4-1-9(8-26-16)19(23,24)25/h1-8,28H,(H,27,29).
What are the key properties of 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide?
3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide has a molecular weight of 477.65 g/mol, XLogP of 6.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-2-hydroxybenzamide is sourced from PubChem (CID 10116535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).