6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine

C8H12N4O — CID 96628819

IUPAC6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine
SMILESCc1nc2onc(C(C)C)n2c1N
InChIInChI=1S/C8H12N4O/c1-4(2)7-11-13-8-10-5(3)6(9)12(7)8/h4H,9H2,1-3H3
InChIKeyQFKOEHOJQXWNCD-UHFFFAOYSA-N
MW180.21 g/mol
LogP1.34
Rot. Bonds1

About 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine

6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine (PubChem CID 96628819) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine.

Molecular Properties

Compound Name6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine
PubChem CID96628819
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine
SMILESCc1nc2onc(C(C)C)n2c1N
InChIInChI=1S/C8H12N4O/c1-4(2)7-11-13-8-10-5(3)6(9)12(7)8/h4H,9H2,1-3H3
InChIKeyQFKOEHOJQXWNCD-UHFFFAOYSA-N
XLogP1.34
TPSA69.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine?
The IUPAC name of 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine (CID 96628819) is 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine.
What is the SMILES notation for 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine?
The canonical SMILES for 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine is Cc1nc2onc(C(C)C)n2c1N.
What is the InChIKey of 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine?
The InChIKey is QFKOEHOJQXWNCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c1-4(2)7-11-13-8-10-5(3)6(9)12(7)8/h4H,9H2,1-3H3.
What are the key properties of 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine?
6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine has a molecular weight of 180.21 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-propan-2-ylimidazo[1,2-d][1,2,4]oxadiazol-5-amine is sourced from PubChem (CID 96628819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).