1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine

C15H28N4O — CID 79678942

IUPAC1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine
SMILESCN(C)C(C)(C)COc1cncc(CNC(C)(C)C)n1
InChIInChI=1S/C15H28N4O/c1-14(2,3)17-9-12-8-16-10-13(18-12)20-11-15(4,5)19(6)7/h8,10,17H,9,11H2,1-7H3
InChIKeyXGFPKMSXWFBZPQ-UHFFFAOYSA-N
MW280.42 g/mol
LogP2.08
Rot. Bonds6

About 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine

1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine (PubChem CID 79678942) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine.

Molecular Properties

Compound Name1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine
PubChem CID79678942
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC Name1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine
SMILESCN(C)C(C)(C)COc1cncc(CNC(C)(C)C)n1
InChIInChI=1S/C15H28N4O/c1-14(2,3)17-9-12-8-16-10-13(18-12)20-11-15(4,5)19(6)7/h8,10,17H,9,11H2,1-7H3
InChIKeyXGFPKMSXWFBZPQ-UHFFFAOYSA-N
XLogP2.08
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-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

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine?
The IUPAC name of 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine (CID 79678942) is 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine.
What is the SMILES notation for 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine?
The canonical SMILES for 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine is CN(C)C(C)(C)COc1cncc(CNC(C)(C)C)n1.
What is the InChIKey of 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine?
The InChIKey is XGFPKMSXWFBZPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-14(2,3)17-9-12-8-16-10-13(18-12)20-11-15(4,5)19(6)7/h8,10,17H,9,11H2,1-7H3.
What are the key properties of 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine?
1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine has a molecular weight of 280.42 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine is sourced from PubChem (CID 79678942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).