1-ethyl-N-methylimidazol-4-amine

C6H11N3 — CID 175451151

IUPAC1-ethyl-N-methylimidazol-4-amine
SMILESCCn1cnc(NC)c1
InChIInChI=1S/C6H11N3/c1-3-9-4-6(7-2)8-5-9/h4-5,7H,3H2,1-2H3
InChIKeyPIEKPBKMYWAUTH-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.94
Rot. Bonds2

About 1-ethyl-N-methylimidazol-4-amine

1-ethyl-N-methylimidazol-4-amine (PubChem CID 175451151) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 1-ethyl-N-methylimidazol-4-amine.

Molecular Properties

Compound Name1-ethyl-N-methylimidazol-4-amine
PubChem CID175451151
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name1-ethyl-N-methylimidazol-4-amine
SMILESCCn1cnc(NC)c1
InChIInChI=1S/C6H11N3/c1-3-9-4-6(7-2)8-5-9/h4-5,7H,3H2,1-2H3
InChIKeyPIEKPBKMYWAUTH-UHFFFAOYSA-N
XLogP0.94
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methylimidazole
CID 12749
1-Methylimidazole
CID 1390
Butylimidazole
CID 61347
1,2-Dimethylimidazole
CID 15617
2-Ethylimidazole
CID 66130
1-Vinylimidazole
CID 66171
1H-Imidazole-1-propanamine
CID 78736
1-Ethyl-3-methylimidazolium chloride
CID 2734160
1H-Imidazolium, 3-ethyl-1-methyl-, salt with N-cyanocyanamide (1:1)
CID 11159638
n-Propylimidazole
CID 118785
1-Ethyl-3-methylimidazolium iodide
CID 11075478
1-Methyl-3-propylimidazolium Iodide
CID 12971008

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-methylimidazol-4-amine?
The IUPAC name of 1-ethyl-N-methylimidazol-4-amine (CID 175451151) is 1-ethyl-N-methylimidazol-4-amine.
What is the SMILES notation for 1-ethyl-N-methylimidazol-4-amine?
The canonical SMILES for 1-ethyl-N-methylimidazol-4-amine is CCn1cnc(NC)c1.
What is the InChIKey of 1-ethyl-N-methylimidazol-4-amine?
The InChIKey is PIEKPBKMYWAUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-3-9-4-6(7-2)8-5-9/h4-5,7H,3H2,1-2H3.
What are the key properties of 1-ethyl-N-methylimidazol-4-amine?
1-ethyl-N-methylimidazol-4-amine has a molecular weight of 125.17 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-methylimidazol-4-amine is sourced from PubChem (CID 175451151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).