6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine

C18H14F3N7OS — CID 148834172

IUPAC6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine
SMILESCc1cncc(N(Cc2ccc(-c3noc(C(F)(F)F)n3)s2)c2cncc(C)n2)n1
InChIInChI=1S/C18H14F3N7OS/c1-10-5-22-7-14(24-10)28(15-8-23-6-11(2)25-15)9-12-3-4-13(30-12)16-26-17(29-27-16)18(19,20)21/h3-8H,9H2,1-2H3
InChIKeyOUGMNBNXMHCDMZ-UHFFFAOYSA-N
MW433.42 g/mol
LogP4.35
Rot. Bonds5

About 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine

6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine (PubChem CID 148834172) has the molecular formula C18H14F3N7OS and a molecular weight of 433.42 g/mol. Its IUPAC name is 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine
PubChem CID148834172
Molecular FormulaC18H14F3N7OS
Molecular Weight433.42 g/mol
Exact Mass433.09
IUPAC Name6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine
SMILESCc1cncc(N(Cc2ccc(-c3noc(C(F)(F)F)n3)s2)c2cncc(C)n2)n1
InChIInChI=1S/C18H14F3N7OS/c1-10-5-22-7-14(24-10)28(15-8-23-6-11(2)25-15)9-12-3-4-13(30-12)16-26-17(29-27-16)18(19,20)21/h3-8H,9H2,1-2H3
InChIKeyOUGMNBNXMHCDMZ-UHFFFAOYSA-N
XLogP4.35
TPSA93.72 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.42
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine with MolForge

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Related Compounds

ethane;3-(5-ethylthiophen-2-yl)-5-(trifluoromethyl)-1,2,4-oxadiazole;6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine
CID 153337919
N-(6-methoxypyrazin-2-yl)-6-methyl-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine
CID 155793450
N-(5,6-dimethyl-2-pyridinyl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine
CID 175075007
N-pyridin-2-yl-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyridin-2-amine
CID 153337946
N-pyrazin-2-yl-5-(trifluoromethyl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine
CID 153337893
2-methoxy-N-pyrazin-2-yl-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrimidin-4-amine
CID 153338005
CID 159429171
CID 159429171
N-methyl-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]acetamide
CID 142423214
2-methylsulfonyl-N-pyrazin-2-yl-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrimidin-5-amine
CID 153337875
7-methyl-N-pyrazin-2-yl-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-amine
CID 149398359
3-[5-(bromomethyl)thiophen-2-yl]-5-(trifluoromethyl)-1,2,4-oxadiazole
CID 135318835
2-methylpropyl 3-[pyrazin-2-yl-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]amino]pyrazine-2-carboxylate
CID 148641946

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine?
The IUPAC name of 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine (CID 148834172) is 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine.
What is the SMILES notation for 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine?
The canonical SMILES for 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine is Cc1cncc(N(Cc2ccc(-c3noc(C(F)(F)F)n3)s2)c2cncc(C)n2)n1.
What is the InChIKey of 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine?
The InChIKey is OUGMNBNXMHCDMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F3N7OS/c1-10-5-22-7-14(24-10)28(15-8-23-6-11(2)25-15)9-12-3-4-13(30-12)16-26-17(29-27-16)18(19,20)21/h3-8H,9H2,1-2H3.
What are the key properties of 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine?
6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine has a molecular weight of 433.42 g/mol, XLogP of 4.35, 5 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(6-methylpyrazin-2-yl)-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]pyrazin-2-amine is sourced from PubChem (CID 148834172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).