1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine

C15H27N3O — CID 64985643

IUPAC1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine
SMILESCCCNC(Cc1nc(C2CCC2)no1)C(C)(C)C
InChIInChI=1S/C15H27N3O/c1-5-9-16-12(15(2,3)4)10-13-17-14(18-19-13)11-7-6-8-11/h11-12,16H,5-10H2,1-4H3
InChIKeyYGHWSRKNDPIEFZ-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.29
Rot. Bonds6

About 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine

1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine (PubChem CID 64985643) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine.

Molecular Properties

Compound Name1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine
PubChem CID64985643
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine
SMILESCCCNC(Cc1nc(C2CCC2)no1)C(C)(C)C
InChIInChI=1S/C15H27N3O/c1-5-9-16-12(15(2,3)4)10-13-17-14(18-19-13)11-7-6-8-11/h11-12,16H,5-10H2,1-4H3
InChIKeyYGHWSRKNDPIEFZ-UHFFFAOYSA-N
XLogP3.29
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine?
The IUPAC name of 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine (CID 64985643) is 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine.
What is the SMILES notation for 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine?
The canonical SMILES for 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine is CCCNC(Cc1nc(C2CCC2)no1)C(C)(C)C.
What is the InChIKey of 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine?
The InChIKey is YGHWSRKNDPIEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-5-9-16-12(15(2,3)4)10-13-17-14(18-19-13)11-7-6-8-11/h11-12,16H,5-10H2,1-4H3.
What are the key properties of 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine?
1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine has a molecular weight of 265.40 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-3,3-dimethyl-N-propylbutan-2-amine is sourced from PubChem (CID 64985643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).