1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine

C8H17N3O — CID 79509606

IUPAC1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine
SMILESCCN1C(N)=NCC1(C)COC
InChIInChI=1S/C8H17N3O/c1-4-11-7(9)10-5-8(11,2)6-12-3/h4-6H2,1-3H3,(H2,9,10)
InChIKeyBZDLBCHBPKPIEF-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.04
Rot. Bonds3

About 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine

1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine (PubChem CID 79509606) has the molecular formula C8H17N3O and a molecular weight of 171.24 g/mol. Its IUPAC name is 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine
PubChem CID79509606
Molecular FormulaC8H17N3O
Molecular Weight171.24 g/mol
Exact Mass171.14
IUPAC Name1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine
SMILESCCN1C(N)=NCC1(C)COC
InChIInChI=1S/C8H17N3O/c1-4-11-7(9)10-5-8(11,2)6-12-3/h4-6H2,1-3H3,(H2,9,10)
InChIKeyBZDLBCHBPKPIEF-UHFFFAOYSA-N
XLogP0.04
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine?
The IUPAC name of 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine (CID 79509606) is 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine.
What is the SMILES notation for 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine?
The canonical SMILES for 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine is CCN1C(N)=NCC1(C)COC.
What is the InChIKey of 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine?
The InChIKey is BZDLBCHBPKPIEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O/c1-4-11-7(9)10-5-8(11,2)6-12-3/h4-6H2,1-3H3,(H2,9,10).
What are the key properties of 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine?
1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine has a molecular weight of 171.24 g/mol, XLogP of 0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine is sourced from PubChem (CID 79509606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).