ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine

C10H15F3N2O — CID 156715262

IUPACethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine
SMILESCC.COc1c(C(F)(F)F)ncc(N)c1C
InChIInChI=1S/C8H9F3N2O.C2H6/c1-4-5(12)3-13-7(6(4)14-2)8(9,10)11;1-2/h3H,12H2,1-2H3;1-2H3
InChIKeyGGLIYEHRQVZFPO-UHFFFAOYSA-N
MW236.24 g/mol
LogP3.03
Rot. Bonds1

About ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine

ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 156715262) has the molecular formula C10H15F3N2O and a molecular weight of 236.24 g/mol. Its IUPAC name is ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Nameethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine
PubChem CID156715262
Molecular FormulaC10H15F3N2O
Molecular Weight236.24 g/mol
Exact Mass236.11
IUPAC Nameethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine
SMILESCC.COc1c(C(F)(F)F)ncc(N)c1C
InChIInChI=1S/C8H9F3N2O.C2H6/c1-4-5(12)3-13-7(6(4)14-2)8(9,10)11;1-2/h3H,12H2,1-2H3;1-2H3
InChIKeyGGLIYEHRQVZFPO-UHFFFAOYSA-N
XLogP3.03
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine (CID 156715262) is ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine is CC.COc1c(C(F)(F)F)ncc(N)c1C.
What is the InChIKey of ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is GGLIYEHRQVZFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2O.C2H6/c1-4-5(12)3-13-7(6(4)14-2)8(9,10)11;1-2/h3H,12H2,1-2H3;1-2H3.
What are the key properties of ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine?
ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 236.24 g/mol, XLogP of 3.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxy-4-methyl-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 156715262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).