5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine

C9H17N3O — CID 130748166

IUPAC5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine
SMILESCOC(C)(C)c1nc(C)n(C)c1N
InChIInChI=1S/C9H17N3O/c1-6-11-7(8(10)12(6)4)9(2,3)13-5/h10H2,1-5H3
InChIKeyJOQYWDKPERGFIP-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.19
Rot. Bonds2

About 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine

5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine (PubChem CID 130748166) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine.

Molecular Properties

Compound Name5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine
PubChem CID130748166
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine
SMILESCOC(C)(C)c1nc(C)n(C)c1N
InChIInChI=1S/C9H17N3O/c1-6-11-7(8(10)12(6)4)9(2,3)13-5/h10H2,1-5H3
InChIKeyJOQYWDKPERGFIP-UHFFFAOYSA-N
XLogP1.19
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine?
The IUPAC name of 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine (CID 130748166) is 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine.
What is the SMILES notation for 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine?
The canonical SMILES for 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine is COC(C)(C)c1nc(C)n(C)c1N.
What is the InChIKey of 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine?
The InChIKey is JOQYWDKPERGFIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-6-11-7(8(10)12(6)4)9(2,3)13-5/h10H2,1-5H3.
What are the key properties of 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine?
5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine has a molecular weight of 183.25 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxypropan-2-yl)-2,3-dimethylimidazol-4-amine is sourced from PubChem (CID 130748166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).