3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole

C10H16N2O — CID 176864448

IUPAC3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole
SMILESCc1noc(C2CC(C(C)C)C2)n1
InChIInChI=1S/C10H16N2O/c1-6(2)8-4-9(5-8)10-11-7(3)12-13-10/h6,8-9H,4-5H2,1-3H3
InChIKeyUGAOCFNYXRGTQC-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.53
Rot. Bonds2

About 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole

3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole (PubChem CID 176864448) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole
PubChem CID176864448
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole
SMILESCc1noc(C2CC(C(C)C)C2)n1
InChIInChI=1S/C10H16N2O/c1-6(2)8-4-9(5-8)10-11-7(3)12-13-10/h6,8-9H,4-5H2,1-3H3
InChIKeyUGAOCFNYXRGTQC-UHFFFAOYSA-N
XLogP2.53
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole with MolForge

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

Launch Full Analysis

Related Compounds

3-methyl-5-[(3S,5S)-5-methylpiperidin-3-yl]-1,2,4-oxadiazole
CID 58487567
3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
CID 66033169
CID 162193867
CID 162193867
3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine
CID 63043501
3-methyl-5-(1-methylpiperidin-4-yl)-1,2,4-oxadiazole
CID 21476662
4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-one
CID 63346585
3-methyl-5-(2-propan-2-ylpyrrolidin-3-yl)-1,2,4-oxadiazole
CID 130763039
2-fluoro-4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine
CID 147477748
3-methyl-5-[(3R)-1-methylpyrrolidin-3-yl]-1,2,4-oxadiazole
CID 92845934
5-(3,3-dimethylcyclopentyl)-3-methyl-1,2,4-oxadiazole
CID 127801903
5-[(2R,4R)-4-methoxypyrrolidin-2-yl]-3-methyl-1,2,4-oxadiazole;hydrochloride
CID 86775507
3-methyl-5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazole
CID 67986572

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole?
The IUPAC name of 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole (CID 176864448) is 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole.
What is the SMILES notation for 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole?
The canonical SMILES for 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole is Cc1noc(C2CC(C(C)C)C2)n1.
What is the InChIKey of 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole?
The InChIKey is UGAOCFNYXRGTQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-6(2)8-4-9(5-8)10-11-7(3)12-13-10/h6,8-9H,4-5H2,1-3H3.
What are the key properties of 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole?
3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole has a molecular weight of 180.25 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(3-propan-2-ylcyclobutyl)-1,2,4-oxadiazole is sourced from PubChem (CID 176864448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).