6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine

C10H14F3N3 — CID 83122822

IUPAC6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine
SMILESCC(N)c1ccc(N(C)CC(F)(F)F)cn1
InChIInChI=1S/C10H14F3N3/c1-7(14)9-4-3-8(5-15-9)16(2)6-10(11,12)13/h3-5,7H,6,14H2,1-2H3
InChIKeyJGLJYKBGFBCJBW-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.10
Rot. Bonds3

About 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine

6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine (PubChem CID 83122822) has the molecular formula C10H14F3N3 and a molecular weight of 233.24 g/mol. Its IUPAC name is 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine
PubChem CID83122822
Molecular FormulaC10H14F3N3
Molecular Weight233.24 g/mol
Exact Mass233.11
IUPAC Name6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine
SMILESCC(N)c1ccc(N(C)CC(F)(F)F)cn1
InChIInChI=1S/C10H14F3N3/c1-7(14)9-4-3-8(5-15-9)16(2)6-10(11,12)13/h3-5,7H,6,14H2,1-2H3
InChIKeyJGLJYKBGFBCJBW-UHFFFAOYSA-N
XLogP2.10
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine?
The IUPAC name of 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine (CID 83122822) is 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine.
What is the SMILES notation for 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine?
The canonical SMILES for 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine is CC(N)c1ccc(N(C)CC(F)(F)F)cn1.
What is the InChIKey of 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine?
The InChIKey is JGLJYKBGFBCJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3/c1-7(14)9-4-3-8(5-15-9)16(2)6-10(11,12)13/h3-5,7H,6,14H2,1-2H3.
What are the key properties of 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine?
6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine has a molecular weight of 233.24 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine is sourced from PubChem (CID 83122822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).