3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide

C19H14F3N3O4 — CID 18681912

IUPAC3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)Nc2ccc(Oc3cc(C(F)(F)F)ccn3)cc2)c1O
InChIInChI=1S/C19H14F3N3O4/c1-28-14-7-9-24-16(17(14)26)18(27)25-12-2-4-13(5-3-12)29-15-10-11(6-8-23-15)19(20,21)22/h2-10,26H,1H3,(H,25,27)
InChIKeyAROGWGPGVNQERW-UHFFFAOYSA-N
MW405.33 g/mol
LogP4.25
Rot. Bonds5

About 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide

3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide (PubChem CID 18681912) has the molecular formula C19H14F3N3O4 and a molecular weight of 405.33 g/mol. Its IUPAC name is 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide
PubChem CID18681912
Molecular FormulaC19H14F3N3O4
Molecular Weight405.33 g/mol
Exact Mass405.09
IUPAC Name3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)Nc2ccc(Oc3cc(C(F)(F)F)ccn3)cc2)c1O
InChIInChI=1S/C19H14F3N3O4/c1-28-14-7-9-24-16(17(14)26)18(27)25-12-2-4-13(5-3-12)29-15-10-11(6-8-23-15)19(20,21)22/h2-10,26H,1H3,(H,25,27)
InChIKeyAROGWGPGVNQERW-UHFFFAOYSA-N
XLogP4.25
TPSA93.57 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.33
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide with MolForge

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Related Compounds

3-hydroxy-4-methoxy-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 11244594
3-hydroxy-4-methoxy-N-[4-[3-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]oxyphenyl]pyridine-2-carboxamide
CID 142045894
3-hydroxy-4-methoxy-N-[3-methyl-4-(4-methylphenoxy)phenyl]pyridine-2-carboxamide
CID 69497629
N-[4-(4,4-dimethylcyclohexyl)oxyphenyl]-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 129104491
3-hydroxy-4-methoxy-N-(4-morpholin-4-ylphenyl)pyridine-2-carboxamide
CID 21088857
[4-methyl-2-[[4-[4-(trifluoromethyl)phenoxy]phenyl]carbamoyl]-3-pyridinyl] acetate
CID 20636750
3-[[2-(4-methoxyphenoxy)-5-(trifluoromethyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid
CID 2811387
3-hydroxy-4-methoxy-N-pyridin-2-ylpyridine-2-carboxamide
CID 21088884
3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide
CID 142553714
N-[5,7-bis(4-fluorophenoxy)-1,3-benzothiazol-2-yl]-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 139337352
(2S)-N-[2-methoxy-5-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 166073828
methyl 2-[2-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]acetate
CID 142566690

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide?
The IUPAC name of 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide (CID 18681912) is 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide?
The canonical SMILES for 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide is COc1ccnc(C(=O)Nc2ccc(Oc3cc(C(F)(F)F)ccn3)cc2)c1O.
What is the InChIKey of 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide?
The InChIKey is AROGWGPGVNQERW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N3O4/c1-28-14-7-9-24-16(17(14)26)18(27)25-12-2-4-13(5-3-12)29-15-10-11(6-8-23-15)19(20,21)22/h2-10,26H,1H3,(H,25,27).
What are the key properties of 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide?
3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide has a molecular weight of 405.33 g/mol, XLogP of 4.25, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-methoxy-N-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 18681912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).