N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine

C10H17N3O — CID 102698959

IUPACN-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine
SMILESCOC(C)CNc1cnc(C)c(C)n1
InChIInChI=1S/C10H17N3O/c1-7(14-4)5-12-10-6-11-8(2)9(3)13-10/h6-7H,5H2,1-4H3,(H,12,13)
InChIKeyKKIIHKNJHXIYOB-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.54
Rot. Bonds4

About N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine

N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine (PubChem CID 102698959) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine.

Molecular Properties

Compound NameN-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine
PubChem CID102698959
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine
SMILESCOC(C)CNc1cnc(C)c(C)n1
InChIInChI=1S/C10H17N3O/c1-7(14-4)5-12-10-6-11-8(2)9(3)13-10/h6-7H,5H2,1-4H3,(H,12,13)
InChIKeyKKIIHKNJHXIYOB-UHFFFAOYSA-N
XLogP1.54
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine?
The IUPAC name of N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine (CID 102698959) is N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine.
What is the SMILES notation for N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine?
The canonical SMILES for N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine is COC(C)CNc1cnc(C)c(C)n1.
What is the InChIKey of N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine?
The InChIKey is KKIIHKNJHXIYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7(14-4)5-12-10-6-11-8(2)9(3)13-10/h6-7H,5H2,1-4H3,(H,12,13).
What are the key properties of N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine?
N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine has a molecular weight of 195.27 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypropyl)-5,6-dimethylpyrazin-2-amine is sourced from PubChem (CID 102698959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).