N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine

C15H19N3O — CID 80863610

IUPACN-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine
SMILESCNc1cncc(Oc2cc(C)ccc2C(C)C)n1
InChIInChI=1S/C15H19N3O/c1-10(2)12-6-5-11(3)7-13(12)19-15-9-17-8-14(16-4)18-15/h5-10H,1-4H3,(H,16,18)
InChIKeyGCYSCSHKUNJIGJ-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.74
Rot. Bonds4

About N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine

N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine (PubChem CID 80863610) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine
PubChem CID80863610
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine
SMILESCNc1cncc(Oc2cc(C)ccc2C(C)C)n1
InChIInChI=1S/C15H19N3O/c1-10(2)12-6-5-11(3)7-13(12)19-15-9-17-8-14(16-4)18-15/h5-10H,1-4H3,(H,16,18)
InChIKeyGCYSCSHKUNJIGJ-UHFFFAOYSA-N
XLogP3.74
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine?
The IUPAC name of N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine (CID 80863610) is N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine.
What is the SMILES notation for N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine?
The canonical SMILES for N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine is CNc1cncc(Oc2cc(C)ccc2C(C)C)n1.
What is the InChIKey of N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine?
The InChIKey is GCYSCSHKUNJIGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10(2)12-6-5-11(3)7-13(12)19-15-9-17-8-14(16-4)18-15/h5-10H,1-4H3,(H,16,18).
What are the key properties of N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine?
N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrazin-2-amine is sourced from PubChem (CID 80863610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).