6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine

C12H19F3N4 — CID 66457825

IUPAC6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
SMILESCCNCc1cncc(N(CC(F)(F)F)C(C)C)n1
InChIInChI=1S/C12H19F3N4/c1-4-16-5-10-6-17-7-11(18-10)19(9(2)3)8-12(13,14)15/h6-7,9,16H,4-5,8H2,1-3H3
InChIKeyHCMULGLOJRZHFV-UHFFFAOYSA-N
MW276.31 g/mol
LogP2.36
Rot. Bonds6

About 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine

6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine (PubChem CID 66457825) has the molecular formula C12H19F3N4 and a molecular weight of 276.31 g/mol. Its IUPAC name is 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
PubChem CID66457825
Molecular FormulaC12H19F3N4
Molecular Weight276.31 g/mol
Exact Mass276.16
IUPAC Name6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
SMILESCCNCc1cncc(N(CC(F)(F)F)C(C)C)n1
InChIInChI=1S/C12H19F3N4/c1-4-16-5-10-6-17-7-11(18-10)19(9(2)3)8-12(13,14)15/h6-7,9,16H,4-5,8H2,1-3H3
InChIKeyHCMULGLOJRZHFV-UHFFFAOYSA-N
XLogP2.36
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-(ethylaminomethyl)-N-propan-2-ylpyrazin-2-amine
CID 66457590
6-[(tert-butylamino)methyl]-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
CID 66458019
6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 62282477
6-(ethylaminomethyl)-N-(2-methylpropyl)-N-pentan-3-ylpyrazin-2-amine
CID 79488795
6-hydrazinyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
CID 80900840
2-N-propan-2-yl-6-N-propyl-2-N-(2,2,2-trifluoroethyl)pyrazine-2,6-diamine
CID 80814943
6-(ethylaminomethyl)-N-(2-methoxyethyl)-N-pentan-3-ylpyrazin-2-amine
CID 66451454
N-[[6-(1,1,1-trifluoropropan-2-yloxy)pyrazin-2-yl]methyl]ethanamine
CID 66467965
N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyrazin-2-amine
CID 66457612
6-[(tert-butylamino)methyl]-N-(2-methylpropyl)-N-propan-2-ylpyrazin-2-amine
CID 66449687
6-[(cyclopropylamino)methyl]-N-ethyl-N-propan-2-ylpyrazin-2-amine
CID 66457788
[6-[propan-2-yl(propyl)amino]pyrazin-2-yl]methanol
CID 66466147

Frequently Asked Questions

What is the IUPAC name of 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The IUPAC name of 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine (CID 66457825) is 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine.
What is the SMILES notation for 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The canonical SMILES for 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine is CCNCc1cncc(N(CC(F)(F)F)C(C)C)n1.
What is the InChIKey of 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The InChIKey is HCMULGLOJRZHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19F3N4/c1-4-16-5-10-6-17-7-11(18-10)19(9(2)3)8-12(13,14)15/h6-7,9,16H,4-5,8H2,1-3H3.
What are the key properties of 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine has a molecular weight of 276.31 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine is sourced from PubChem (CID 66457825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).