3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine

C10H15N3O — CID 130927334

IUPAC3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine
SMILESCC1(C)CC1Nc1nc(C2CC2)no1
InChIInChI=1S/C10H15N3O/c1-10(2)5-7(10)11-9-12-8(13-14-9)6-3-4-6/h6-7H,3-5H2,1-2H3,(H,11,12,13)
InChIKeyZGPXMUSLYARFHT-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.16
Rot. Bonds3

About 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine

3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine (PubChem CID 130927334) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine
PubChem CID130927334
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine
SMILESCC1(C)CC1Nc1nc(C2CC2)no1
InChIInChI=1S/C10H15N3O/c1-10(2)5-7(10)11-9-12-8(13-14-9)6-3-4-6/h6-7H,3-5H2,1-2H3,(H,11,12,13)
InChIKeyZGPXMUSLYARFHT-UHFFFAOYSA-N
XLogP2.16
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine?
The IUPAC name of 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine (CID 130927334) is 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine?
The canonical SMILES for 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine is CC1(C)CC1Nc1nc(C2CC2)no1.
What is the InChIKey of 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine?
The InChIKey is ZGPXMUSLYARFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-10(2)5-7(10)11-9-12-8(13-14-9)6-3-4-6/h6-7H,3-5H2,1-2H3,(H,11,12,13).
What are the key properties of 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine?
3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine has a molecular weight of 193.25 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 130927334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).