6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine

C15H28N4 — CID 66451243

IUPAC6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine
SMILESCC(C)CCN(C)c1cncc(CNC(C)(C)C)n1
InChIInChI=1S/C15H28N4/c1-12(2)7-8-19(6)14-11-16-9-13(18-14)10-17-15(3,4)5/h9,11-12,17H,7-8,10H2,1-6H3
InChIKeyHEJDBKBDGXCUMG-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.85
Rot. Bonds6

About 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine

6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine (PubChem CID 66451243) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine
PubChem CID66451243
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine
SMILESCC(C)CCN(C)c1cncc(CNC(C)(C)C)n1
InChIInChI=1S/C15H28N4/c1-12(2)7-8-19(6)14-11-16-9-13(18-14)10-17-15(3,4)5/h9,11-12,17H,7-8,10H2,1-6H3
InChIKeyHEJDBKBDGXCUMG-UHFFFAOYSA-N
XLogP2.85
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine?
The IUPAC name of 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine (CID 66451243) is 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine.
What is the SMILES notation for 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine?
The canonical SMILES for 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine is CC(C)CCN(C)c1cncc(CNC(C)(C)C)n1.
What is the InChIKey of 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine?
The InChIKey is HEJDBKBDGXCUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-12(2)7-8-19(6)14-11-16-9-13(18-14)10-17-15(3,4)5/h9,11-12,17H,7-8,10H2,1-6H3.
What are the key properties of 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine?
6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine has a molecular weight of 264.42 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine is sourced from PubChem (CID 66451243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).