6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine

C12H14F3N5O — CID 71972957

IUPAC6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine
SMILESCOc1cncc(N(C)Cc2nccn2CC(F)(F)F)n1
InChIInChI=1S/C12H14F3N5O/c1-19(9-5-16-6-11(18-9)21-2)7-10-17-3-4-20(10)8-12(13,14)15/h3-6H,7-8H2,1-2H3
InChIKeyDLPWTEJBUXRAKZ-UHFFFAOYSA-N
MW301.27 g/mol
LogP1.88
Rot. Bonds5

About 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine

6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine (PubChem CID 71972957) has the molecular formula C12H14F3N5O and a molecular weight of 301.27 g/mol. Its IUPAC name is 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine
PubChem CID71972957
Molecular FormulaC12H14F3N5O
Molecular Weight301.27 g/mol
Exact Mass301.12
IUPAC Name6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine
SMILESCOc1cncc(N(C)Cc2nccn2CC(F)(F)F)n1
InChIInChI=1S/C12H14F3N5O/c1-19(9-5-16-6-11(18-9)21-2)7-10-17-3-4-20(10)8-12(13,14)15/h3-6H,7-8H2,1-2H3
InChIKeyDLPWTEJBUXRAKZ-UHFFFAOYSA-N
XLogP1.88
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.27
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-Methoxyimidazo[1,2-A]pyrazine
CID 15025842
8-Ethoxy-imidazo[1,2-a]pyrazine
CID 11819361
6-(2,2,2-Trifluoroethoxy)imidazo[1,2-a]pyrazine
CID 135043497
6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine
CID 75522202
2-Iodo-6-(trifluoromethoxy)imidazo[1,2-a]pyrazine
CID 68374699
2-Iodo-5-(trifluoromethoxy)imidazo[1,2-a]pyrazine
CID 68374701
2-Iodo-3-(trifluoromethoxy)imidazo[1,2-a]pyrazine
CID 68374702
2-(Trifluoromethoxy)imidazo[1,2-a]pyrazine
CID 68677191
8-(Trifluoromethoxy)imidazo[1,2-a]pyrazine
CID 68677192
1,2-Dimethyl-5-(trifluoromethoxy)imidazole
CID 118466146
1,2-Dimethyl-4-(trifluoromethoxy)imidazole
CID 118466330
1-Methyl-4-(trifluoromethoxy)imidazole
CID 123263183

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine?
The IUPAC name of 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine (CID 71972957) is 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine.
What is the SMILES notation for 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine?
The canonical SMILES for 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine is COc1cncc(N(C)Cc2nccn2CC(F)(F)F)n1.
What is the InChIKey of 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine?
The InChIKey is DLPWTEJBUXRAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F3N5O/c1-19(9-5-16-6-11(18-9)21-2)7-10-17-3-4-20(10)8-12(13,14)15/h3-6H,7-8H2,1-2H3.
What are the key properties of 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine?
6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine has a molecular weight of 301.27 g/mol, XLogP of 1.88, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrazin-2-amine is sourced from PubChem (CID 71972957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).