6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine

C12H22N4 — CID 66456241

IUPAC6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine
SMILESCC(N(C)c1cncc(CN)n1)C(C)(C)C
InChIInChI=1S/C12H22N4/c1-9(12(2,3)4)16(5)11-8-14-7-10(6-13)15-11/h7-9H,6,13H2,1-5H3
InChIKeyZUHQMXZBCJXAAK-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.81
Rot. Bonds3

About 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine

6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine (PubChem CID 66456241) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine
PubChem CID66456241
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine
SMILESCC(N(C)c1cncc(CN)n1)C(C)(C)C
InChIInChI=1S/C12H22N4/c1-9(12(2,3)4)16(5)11-8-14-7-10(6-13)15-11/h7-9H,6,13H2,1-5H3
InChIKeyZUHQMXZBCJXAAK-UHFFFAOYSA-N
XLogP1.81
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine?
The IUPAC name of 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine (CID 66456241) is 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine.
What is the SMILES notation for 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine?
The canonical SMILES for 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine is CC(N(C)c1cncc(CN)n1)C(C)(C)C.
What is the InChIKey of 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine?
The InChIKey is ZUHQMXZBCJXAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-9(12(2,3)4)16(5)11-8-14-7-10(6-13)15-11/h7-9H,6,13H2,1-5H3.
What are the key properties of 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine?
6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine has a molecular weight of 222.34 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylpyrazin-2-amine is sourced from PubChem (CID 66456241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).