6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile

C10H14N4O — CID 167788703

IUPAC6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile
SMILESCOC(C)(C)CNc1cncc(C#N)n1
InChIInChI=1S/C10H14N4O/c1-10(2,15-3)7-13-9-6-12-5-8(4-11)14-9/h5-6H,7H2,1-3H3,(H,13,14)
InChIKeyJARZLRQKZKBOSS-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.19
Rot. Bonds4

About 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile

6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile (PubChem CID 167788703) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile
PubChem CID167788703
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile
SMILESCOC(C)(C)CNc1cncc(C#N)n1
InChIInChI=1S/C10H14N4O/c1-10(2,15-3)7-13-9-6-12-5-8(4-11)14-9/h5-6H,7H2,1-3H3,(H,13,14)
InChIKeyJARZLRQKZKBOSS-UHFFFAOYSA-N
XLogP1.19
TPSA70.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile?
The IUPAC name of 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile (CID 167788703) is 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile.
What is the SMILES notation for 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile?
The canonical SMILES for 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile is COC(C)(C)CNc1cncc(C#N)n1.
What is the InChIKey of 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile?
The InChIKey is JARZLRQKZKBOSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-10(2,15-3)7-13-9-6-12-5-8(4-11)14-9/h5-6H,7H2,1-3H3,(H,13,14).
What are the key properties of 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile?
6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile has a molecular weight of 206.25 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methoxy-2-methylpropyl)amino]pyrazine-2-carbonitrile is sourced from PubChem (CID 167788703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).