N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine

C11H19N3O2 — CID 106451330

IUPACN-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine
SMILESCNc1cncc(OCCOCC(C)C)n1
InChIInChI=1S/C11H19N3O2/c1-9(2)8-15-4-5-16-11-7-13-6-10(12-3)14-11/h6-7,9H,4-5,8H2,1-3H3,(H,12,14)
InChIKeySACLOEFVDGCYSU-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.57
Rot. Bonds7

About N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine

N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine (PubChem CID 106451330) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine
PubChem CID106451330
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine
SMILESCNc1cncc(OCCOCC(C)C)n1
InChIInChI=1S/C11H19N3O2/c1-9(2)8-15-4-5-16-11-7-13-6-10(12-3)14-11/h6-7,9H,4-5,8H2,1-3H3,(H,12,14)
InChIKeySACLOEFVDGCYSU-UHFFFAOYSA-N
XLogP1.57
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine?
The IUPAC name of N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine (CID 106451330) is N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine.
What is the SMILES notation for N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine?
The canonical SMILES for N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine is CNc1cncc(OCCOCC(C)C)n1.
What is the InChIKey of N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine?
The InChIKey is SACLOEFVDGCYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-9(2)8-15-4-5-16-11-7-13-6-10(12-3)14-11/h6-7,9H,4-5,8H2,1-3H3,(H,12,14).
What are the key properties of N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine?
N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine has a molecular weight of 225.29 g/mol, XLogP of 1.57, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[2-(2-methylpropoxy)ethoxy]pyrazin-2-amine is sourced from PubChem (CID 106451330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).