2-ethyl-4-methylimidazole-1,5-diamine

C6H12N4 — CID 62483589

IUPAC2-ethyl-4-methylimidazole-1,5-diamine
SMILESCCc1nc(C)c(N)n1N
InChIInChI=1S/C6H12N4/c1-3-5-9-4(2)6(7)10(5)8/h3,7-8H2,1-2H3
InChIKeyZNYGOZKZTURRAC-UHFFFAOYSA-N
MW140.19 g/mol
LogP0.05
Rot. Bonds1

About 2-ethyl-4-methylimidazole-1,5-diamine

2-ethyl-4-methylimidazole-1,5-diamine (PubChem CID 62483589) has the molecular formula C6H12N4 and a molecular weight of 140.19 g/mol. Its IUPAC name is 2-ethyl-4-methylimidazole-1,5-diamine.

Molecular Properties

Compound Name2-ethyl-4-methylimidazole-1,5-diamine
PubChem CID62483589
Molecular FormulaC6H12N4
Molecular Weight140.19 g/mol
Exact Mass140.11
IUPAC Name2-ethyl-4-methylimidazole-1,5-diamine
SMILESCCc1nc(C)c(N)n1N
InChIInChI=1S/C6H12N4/c1-3-5-9-4(2)6(7)10(5)8/h3,7-8H2,1-2H3
InChIKeyZNYGOZKZTURRAC-UHFFFAOYSA-N
XLogP0.05
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methylimidazole-1,5-diamine?
The IUPAC name of 2-ethyl-4-methylimidazole-1,5-diamine (CID 62483589) is 2-ethyl-4-methylimidazole-1,5-diamine.
What is the SMILES notation for 2-ethyl-4-methylimidazole-1,5-diamine?
The canonical SMILES for 2-ethyl-4-methylimidazole-1,5-diamine is CCc1nc(C)c(N)n1N.
What is the InChIKey of 2-ethyl-4-methylimidazole-1,5-diamine?
The InChIKey is ZNYGOZKZTURRAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4/c1-3-5-9-4(2)6(7)10(5)8/h3,7-8H2,1-2H3.
What are the key properties of 2-ethyl-4-methylimidazole-1,5-diamine?
2-ethyl-4-methylimidazole-1,5-diamine has a molecular weight of 140.19 g/mol, XLogP of 0.05, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methylimidazole-1,5-diamine is sourced from PubChem (CID 62483589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).