6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol

C6H4ClF3N2O2 — CID 118999095

IUPAC6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol
SMILESNc1nc(Cl)c(O)cc1OC(F)(F)F
InChIInChI=1S/C6H4ClF3N2O2/c7-4-2(13)1-3(5(11)12-4)14-6(8,9)10/h1,13H,(H2,11,12)
InChIKeyGAZJWERCXFZZFZ-UHFFFAOYSA-N
MW228.56 g/mol
LogP1.92
Rot. Bonds1

About 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol

6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol (PubChem CID 118999095) has the molecular formula C6H4ClF3N2O2 and a molecular weight of 228.56 g/mol. Its IUPAC name is 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol.

Molecular Properties

Compound Name6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol
PubChem CID118999095
Molecular FormulaC6H4ClF3N2O2
Molecular Weight228.56 g/mol
Exact Mass227.99
IUPAC Name6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol
SMILESNc1nc(Cl)c(O)cc1OC(F)(F)F
InChIInChI=1S/C6H4ClF3N2O2/c7-4-2(13)1-3(5(11)12-4)14-6(8,9)10/h1,13H,(H2,11,12)
InChIKeyGAZJWERCXFZZFZ-UHFFFAOYSA-N
XLogP1.92
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.56
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-5-hydroxy-3-(trifluoromethoxy)pyridine-2-sulfonyl chloride
CID 119021551
6-chloro-3-(trifluoromethoxy)pyridin-2-amine
CID 118991079
5-amino-2-chloro-3-(trifluoromethoxy)phenol
CID 118850628
methyl 2-[6-amino-2-(aminomethyl)-5-(trifluoromethoxy)-3-pyridinyl]acetate
CID 133086081
5-iodo-3-(trifluoromethoxy)pyridin-2-amine
CID 118999866
6-(aminomethyl)-5-methyl-3-(trifluoromethoxy)pyridin-2-amine
CID 119023621
2-chloro-4-fluoro-6-(trifluoromethoxy)pyridin-3-ol
CID 130785777
2,3,6-trichloro-4-(trifluoromethoxy)pyridine
CID 119007597
4-chloro-2-(trifluoromethoxy)phenol
CID 58046341
3-hydroxy-6-methoxy-5-(trifluoromethoxy)pyridine-2-sulfonamide
CID 134659587
ethyl 2-[6-amino-2-(aminomethyl)-5-(trifluoromethoxy)-3-pyridinyl]acetate
CID 133086121
6-amino-3-cyano-5-(trifluoromethoxy)pyridine-2-carboxamide
CID 119010545

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol?
The IUPAC name of 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol (CID 118999095) is 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol.
What is the SMILES notation for 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol?
The canonical SMILES for 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol is Nc1nc(Cl)c(O)cc1OC(F)(F)F.
What is the InChIKey of 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol?
The InChIKey is GAZJWERCXFZZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClF3N2O2/c7-4-2(13)1-3(5(11)12-4)14-6(8,9)10/h1,13H,(H2,11,12).
What are the key properties of 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol?
6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol has a molecular weight of 228.56 g/mol, XLogP of 1.92, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-chloro-5-(trifluoromethoxy)pyridin-3-ol is sourced from PubChem (CID 118999095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).