5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine

C14H25N3 — CID 114475549

IUPAC5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine
SMILESCc1ncc(NC(C)CCCC(C)C)nc1C
InChIInChI=1S/C14H25N3/c1-10(2)7-6-8-11(3)16-14-9-15-12(4)13(5)17-14/h9-11H,6-8H2,1-5H3,(H,16,17)
InChIKeyQGEAYIWFWIULOF-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.72
Rot. Bonds6

About 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine

5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine (PubChem CID 114475549) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine.

Molecular Properties

Compound Name5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine
PubChem CID114475549
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine
SMILESCc1ncc(NC(C)CCCC(C)C)nc1C
InChIInChI=1S/C14H25N3/c1-10(2)7-6-8-11(3)16-14-9-15-12(4)13(5)17-14/h9-11H,6-8H2,1-5H3,(H,16,17)
InChIKeyQGEAYIWFWIULOF-UHFFFAOYSA-N
XLogP3.72
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine?
The IUPAC name of 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine (CID 114475549) is 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine.
What is the SMILES notation for 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine?
The canonical SMILES for 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine is Cc1ncc(NC(C)CCCC(C)C)nc1C.
What is the InChIKey of 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine?
The InChIKey is QGEAYIWFWIULOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-10(2)7-6-8-11(3)16-14-9-15-12(4)13(5)17-14/h9-11H,6-8H2,1-5H3,(H,16,17).
What are the key properties of 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine?
5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine has a molecular weight of 235.37 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine is sourced from PubChem (CID 114475549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).