6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine

C10H13F3N4 — CID 66457235

IUPAC6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
SMILESNCc1cncc(N(CC(F)(F)F)C2CC2)n1
InChIInChI=1S/C10H13F3N4/c11-10(12,13)6-17(8-1-2-8)9-5-15-4-7(3-14)16-9/h4-5,8H,1-3,6,14H2
InChIKeyMQLJHIPHFFAPOU-UHFFFAOYSA-N
MW246.24 g/mol
LogP1.47
Rot. Bonds4

About 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine

6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine (PubChem CID 66457235) has the molecular formula C10H13F3N4 and a molecular weight of 246.24 g/mol. Its IUPAC name is 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
PubChem CID66457235
Molecular FormulaC10H13F3N4
Molecular Weight246.24 g/mol
Exact Mass246.11
IUPAC Name6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
SMILESNCc1cncc(N(CC(F)(F)F)C2CC2)n1
InChIInChI=1S/C10H13F3N4/c11-10(12,13)6-17(8-1-2-8)9-5-15-4-7(3-14)16-9/h4-5,8H,1-3,6,14H2
InChIKeyMQLJHIPHFFAPOU-UHFFFAOYSA-N
XLogP1.47
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.24
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The IUPAC name of 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine (CID 66457235) is 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine.
What is the SMILES notation for 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The canonical SMILES for 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine is NCc1cncc(N(CC(F)(F)F)C2CC2)n1.
What is the InChIKey of 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The InChIKey is MQLJHIPHFFAPOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N4/c11-10(12,13)6-17(8-1-2-8)9-5-15-4-7(3-14)16-9/h4-5,8H,1-3,6,14H2.
What are the key properties of 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine has a molecular weight of 246.24 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine is sourced from PubChem (CID 66457235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).