6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine

C6H12N4 — CID 123591161

IUPAC6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine
SMILES[H]/N=C1\C(C)N=C(N)CN1C
InChIInChI=1S/C6H12N4/c1-4-6(8)10(2)3-5(7)9-4/h4,8H,3H2,1-2H3,(H2,7,9)/b8-6+
InChIKeyBZTXEHKQMFIDCS-SOFGYWHQSA-N
MW140.19 g/mol
LogP-0.35
Rot. Bonds

About 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine

6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine (PubChem CID 123591161) has the molecular formula C6H12N4 and a molecular weight of 140.19 g/mol. Its IUPAC name is 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine.

Molecular Properties

Compound Name6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine
PubChem CID123591161
Molecular FormulaC6H12N4
Molecular Weight140.19 g/mol
Exact Mass140.11
IUPAC Name6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine
SMILES[H]/N=C1\C(C)N=C(N)CN1C
InChIInChI=1S/C6H12N4/c1-4-6(8)10(2)3-5(7)9-4/h4,8H,3H2,1-2H3,(H2,7,9)/b8-6+
InChIKeyBZTXEHKQMFIDCS-SOFGYWHQSA-N
XLogP-0.35
TPSA65.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-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 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine?
The IUPAC name of 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine (CID 123591161) is 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine.
What is the SMILES notation for 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine?
The canonical SMILES for 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine is [H]/N=C1\C(C)N=C(N)CN1C.
What is the InChIKey of 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine?
The InChIKey is BZTXEHKQMFIDCS-SOFGYWHQSA-N. The full InChI is InChI=1S/C6H12N4/c1-4-6(8)10(2)3-5(7)9-4/h4,8H,3H2,1-2H3,(H2,7,9)/b8-6+.
What are the key properties of 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine?
6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine has a molecular weight of 140.19 g/mol, XLogP of -0.35, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imino-1,5-dimethyl-2,5-dihydropyrazin-3-amine is sourced from PubChem (CID 123591161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).