6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine

C15H8F6N4O — CID 134154158

IUPAC6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine
SMILESNc1nc(C(F)(F)F)ccc1-c1nnc(-c2ccc(C(F)(F)F)cc2)o1
InChIInChI=1S/C15H8F6N4O/c16-14(17,18)8-3-1-7(2-4-8)12-24-25-13(26-12)9-5-6-10(15(19,20)21)23-11(9)22/h1-6H,(H2,22,23)
InChIKeyFHKJAXJVJDBGCI-UHFFFAOYSA-N
MW374.24 g/mol
LogP4.42
Rot. Bonds2

About 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine

6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine (PubChem CID 134154158) has the molecular formula C15H8F6N4O and a molecular weight of 374.24 g/mol. Its IUPAC name is 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine.

Molecular Properties

Compound Name6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine
PubChem CID134154158
Molecular FormulaC15H8F6N4O
Molecular Weight374.24 g/mol
Exact Mass374.06
IUPAC Name6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine
SMILESNc1nc(C(F)(F)F)ccc1-c1nnc(-c2ccc(C(F)(F)F)cc2)o1
InChIInChI=1S/C15H8F6N4O/c16-14(17,18)8-3-1-7(2-4-8)12-24-25-13(26-12)9-5-6-10(15(19,20)21)23-11(9)22/h1-6H,(H2,22,23)
InChIKeyFHKJAXJVJDBGCI-UHFFFAOYSA-N
XLogP4.42
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.24
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(5-(4-(5-(Difluoromethyl)-1,3,4-oxadiazol-2-yl)benzyl)-1,3,4-oxadiazol-2-yl)pyridin-2-amine
CID 162722250
3-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]-6-(trifluoromethyl)pyridin-2-amine
CID 134132159
3-[5-(4-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]-6-(trifluoromethyl)pyridin-2-amine
CID 134133694
3-[5-(4-Bromophenyl)-1,3,4-oxadiazol-2-yl]-6-(trifluoromethyl)pyridin-2-amine
CID 134136485
N-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)-6-(trifluoromethyl)-2-pyridinyl]benzamide
CID 134141890
N-[3-(5-propyl-1,3,4-oxadiazol-2-yl)-6-(trifluoromethyl)-2-pyridinyl]butanamide
CID 134143847
N-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)-6-(trifluoromethyl)-2-pyridinyl]propanamide
CID 134143904
N-(3-fluorophenyl)-3-(5-propyl-1,3,4-oxadiazol-2-yl)-6-(trifluoromethyl)pyridin-2-amine
CID 134146064
3-(5-ethyl-1,3,4-oxadiazol-2-yl)-N-(3-fluorophenyl)-6-(trifluoromethyl)pyridin-2-amine
CID 134153275
2,6-Dimethyl-5-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]pyridine-3-carbohydrazide
CID 3600898
4-(5-{2,6-Difluoro-pyridin-3-yl}-[1,3,4]oxadiazole-2-yl)-benzonitrile
CID 68714463
2-[2,6-Difluoro-4-(2-hydroxypropan-2-yl)phenyl]-5-[[6-methyl-5-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]amino]-2,3-dihydrothiophene-4-carboxamide
CID 70842603

Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine?
The IUPAC name of 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine (CID 134154158) is 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine.
What is the SMILES notation for 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine?
The canonical SMILES for 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine is Nc1nc(C(F)(F)F)ccc1-c1nnc(-c2ccc(C(F)(F)F)cc2)o1.
What is the InChIKey of 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine?
The InChIKey is FHKJAXJVJDBGCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8F6N4O/c16-14(17,18)8-3-1-7(2-4-8)12-24-25-13(26-12)9-5-6-10(15(19,20)21)23-11(9)22/h1-6H,(H2,22,23).
What are the key properties of 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine?
6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine has a molecular weight of 374.24 g/mol, XLogP of 4.42, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)-3-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyridin-2-amine is sourced from PubChem (CID 134154158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).