4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine

C11H12N4O — CID 64982482

IUPAC4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine
SMILESNc1cnccc1-c1nc(C2CCC2)no1
InChIInChI=1S/C11H12N4O/c12-9-6-13-5-4-8(9)11-14-10(15-16-11)7-2-1-3-7/h4-7H,1-3,12H2
InChIKeyYVMALWVZKXKMJO-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.98
Rot. Bonds2

About 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine

4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine (PubChem CID 64982482) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine.

Molecular Properties

Compound Name4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine
PubChem CID64982482
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC Name4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine
SMILESNc1cnccc1-c1nc(C2CCC2)no1
InChIInChI=1S/C11H12N4O/c12-9-6-13-5-4-8(9)11-14-10(15-16-11)7-2-1-3-7/h4-7H,1-3,12H2
InChIKeyYVMALWVZKXKMJO-UHFFFAOYSA-N
XLogP1.98
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine?
The IUPAC name of 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine (CID 64982482) is 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine.
What is the SMILES notation for 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine?
The canonical SMILES for 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine is Nc1cnccc1-c1nc(C2CCC2)no1.
What is the InChIKey of 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine?
The InChIKey is YVMALWVZKXKMJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c12-9-6-13-5-4-8(9)11-14-10(15-16-11)7-2-1-3-7/h4-7H,1-3,12H2.
What are the key properties of 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine?
4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine has a molecular weight of 216.24 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)pyridin-3-amine is sourced from PubChem (CID 64982482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).