5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine

C10H14F3N3 — CID 104533826

IUPAC5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine
SMILESCCN(CC(F)(F)F)c1cncc(NC)c1
InChIInChI=1S/C10H14F3N3/c1-3-16(7-10(11,12)13)9-4-8(14-2)5-15-6-9/h4-6,14H,3,7H2,1-2H3
InChIKeyZZULRPGLIGGBTM-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.51
Rot. Bonds4

About 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine

5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine (PubChem CID 104533826) has the molecular formula C10H14F3N3 and a molecular weight of 233.24 g/mol. Its IUPAC name is 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine
PubChem CID104533826
Molecular FormulaC10H14F3N3
Molecular Weight233.24 g/mol
Exact Mass233.11
IUPAC Name5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine
SMILESCCN(CC(F)(F)F)c1cncc(NC)c1
InChIInChI=1S/C10H14F3N3/c1-3-16(7-10(11,12)13)9-4-8(14-2)5-15-6-9/h4-6,14H,3,7H2,1-2H3
InChIKeyZZULRPGLIGGBTM-UHFFFAOYSA-N
XLogP2.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine?
The IUPAC name of 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine (CID 104533826) is 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine.
What is the SMILES notation for 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine?
The canonical SMILES for 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine is CCN(CC(F)(F)F)c1cncc(NC)c1.
What is the InChIKey of 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine?
The InChIKey is ZZULRPGLIGGBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3/c1-3-16(7-10(11,12)13)9-4-8(14-2)5-15-6-9/h4-6,14H,3,7H2,1-2H3.
What are the key properties of 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine?
5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine has a molecular weight of 233.24 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine is sourced from PubChem (CID 104533826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).