3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine

C12H21N3O — CID 106659651

IUPAC3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine
SMILESCCCC1CCC(Nc2nc(C)no2)CC1
InChIInChI=1S/C12H21N3O/c1-3-4-10-5-7-11(8-6-10)14-12-13-9(2)15-16-12/h10-11H,3-8H2,1-2H3,(H,13,14,15)
InChIKeyMTKZRNZVQHMYKZ-UHFFFAOYSA-N
MW223.32 g/mol
LogP3.15
Rot. Bonds4

About 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine

3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine (PubChem CID 106659651) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound Name3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine
PubChem CID106659651
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine
SMILESCCCC1CCC(Nc2nc(C)no2)CC1
InChIInChI=1S/C12H21N3O/c1-3-4-10-5-7-11(8-6-10)14-12-13-9(2)15-16-12/h10-11H,3-8H2,1-2H3,(H,13,14,15)
InChIKeyMTKZRNZVQHMYKZ-UHFFFAOYSA-N
XLogP3.15
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine 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

N-(azepan-4-yl)-3-methyl-1,2,4-oxadiazol-5-amine
CID 107173618
N-(1-ethylpiperidin-3-yl)-3-methyl-1,2,4-oxadiazol-5-amine
CID 102677438
N-(2,2-diethyloxan-4-yl)-3-methyl-1,2,4-oxadiazol-5-amine
CID 106659872
5-(methylaminomethyl)-N-(4-propylcyclohexyl)-1,3,4-oxadiazol-2-amine
CID 106971262
4-methyl-N-(4-propylcyclohexyl)-1,3-thiazol-2-amine
CID 63540876
3-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-1,2,4-oxadiazol-5-amine
CID 106659795
N-(3,3-dimethylcyclohexyl)-3-methyl-1,2,4-oxadiazol-5-amine
CID 106659849
6-ethoxy-2-methyl-N-(4-propylcyclohexyl)pyrimidin-4-amine
CID 66324652
5-(2-cyclopropylethyl)-3-methyl-1,2,4-oxadiazole
CID 131086308
N-cyclopropyl-3-(4-propylcyclohexyl)-1,2,4-thiadiazol-5-amine
CID 65400997
N-cyclopropyl-3-(1-methoxybutyl)-1,2,4-oxadiazol-5-amine
CID 116730928
3-methyl-N-(4-propylcyclohexyl)quinoxalin-2-amine
CID 63541823

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine?
The IUPAC name of 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine (CID 106659651) is 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine?
The canonical SMILES for 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine is CCCC1CCC(Nc2nc(C)no2)CC1.
What is the InChIKey of 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine?
The InChIKey is MTKZRNZVQHMYKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-3-4-10-5-7-11(8-6-10)14-12-13-9(2)15-16-12/h10-11H,3-8H2,1-2H3,(H,13,14,15).
What are the key properties of 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine?
3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine has a molecular weight of 223.32 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 106659651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).