N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine

C7H8F3N3O — CID 126981645

IUPACN,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine
SMILESCN(C)c1cnc(OC(F)(F)F)cn1
InChIInChI=1S/C7H8F3N3O/c1-13(2)5-3-12-6(4-11-5)14-7(8,9)10/h3-4H,1-2H3
InChIKeyUWHQSCAQMLUEGJ-UHFFFAOYSA-N
MW207.16 g/mol
LogP1.44
Rot. Bonds2

About N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine

N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine (PubChem CID 126981645) has the molecular formula C7H8F3N3O and a molecular weight of 207.16 g/mol. Its IUPAC name is N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine
PubChem CID126981645
Molecular FormulaC7H8F3N3O
Molecular Weight207.16 g/mol
Exact Mass207.06
IUPAC NameN,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine
SMILESCN(C)c1cnc(OC(F)(F)F)cn1
InChIInChI=1S/C7H8F3N3O/c1-13(2)5-3-12-6(4-11-5)14-7(8,9)10/h3-4H,1-2H3
InChIKeyUWHQSCAQMLUEGJ-UHFFFAOYSA-N
XLogP1.44
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.16
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine?
The IUPAC name of N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine (CID 126981645) is N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine.
What is the SMILES notation for N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine?
The canonical SMILES for N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine is CN(C)c1cnc(OC(F)(F)F)cn1.
What is the InChIKey of N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine?
The InChIKey is UWHQSCAQMLUEGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3O/c1-13(2)5-3-12-6(4-11-5)14-7(8,9)10/h3-4H,1-2H3.
What are the key properties of N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine?
N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine has a molecular weight of 207.16 g/mol, XLogP of 1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-(trifluoromethoxy)pyrazin-2-amine is sourced from PubChem (CID 126981645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).