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

C10H15N3O — CID 130591491

IUPAC1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine
SMILESCNC1(c2nc(C3CC3)no2)CCC1
InChIInChI=1S/C10H15N3O/c1-11-10(5-2-6-10)9-12-8(13-14-9)7-3-4-7/h7,11H,2-6H2,1H3
InChIKeyXMQROORHPQDNCR-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.55
Rot. Bonds3

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

1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine (PubChem CID 130591491) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine.

Molecular Properties

Compound Name1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine
PubChem CID130591491
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine
SMILESCNC1(c2nc(C3CC3)no2)CCC1
InChIInChI=1S/C10H15N3O/c1-11-10(5-2-6-10)9-12-8(13-14-9)7-3-4-7/h7,11H,2-6H2,1H3
InChIKeyXMQROORHPQDNCR-UHFFFAOYSA-N
XLogP1.55
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 ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)cyclobutyl]methanamine
CID 115446020
3-cyclohexyl-5-(1-methylsulfonylcyclopentyl)-1,2,4-oxadiazole
CID 71980379
1-(3-cyclohexyl-1,2,4-oxadiazol-5-yl)cyclopropan-1-amine
CID 65466489
1-[3-(4-propan-2-ylcyclohexyl)-1,2,4-oxadiazol-5-yl]cyclohexan-1-amine
CID 65423270
3-cyclopropyl-5-(4-ethylpiperidin-4-yl)-1,2,4-oxadiazole
CID 63126024
1-(3-cycloheptyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine
CID 65391882
5-(1-methylsulfonylcyclopentyl)-3-(oxan-4-yl)-1,2,4-oxadiazole
CID 154738532
3-cyclooctyl-5-(4-methylpiperidin-4-yl)-1,2,4-oxadiazole
CID 80601729
[1-(3-cyclohexyl-1,2,4-oxadiazol-5-yl)cyclopropyl]methanamine
CID 115450845
5-(1-methylcyclopropyl)-3-piperidin-4-yl-1,2,4-oxadiazole
CID 115025293
2-(3-cyclohexyl-1,2,4-oxadiazol-5-yl)-2-methylcyclohexan-1-amine
CID 83213568
2-(3-cyclooctyl-1,2,4-oxadiazol-5-yl)-2-methylcyclohexan-1-amine
CID 83209965

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine?
The IUPAC name of 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine (CID 130591491) is 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine.
What is the SMILES notation for 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine?
The canonical SMILES for 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine is CNC1(c2nc(C3CC3)no2)CCC1.
What is the InChIKey of 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine?
The InChIKey is XMQROORHPQDNCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-11-10(5-2-6-10)9-12-8(13-14-9)7-3-4-7/h7,11H,2-6H2,1H3.
What are the key properties of 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine?
1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine has a molecular weight of 193.25 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-methylcyclobutan-1-amine is sourced from PubChem (CID 130591491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).