[5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine

C10H17N3O — CID 61326432

IUPAC[5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine
SMILESNCc1noc(CC2CCCCC2)n1
InChIInChI=1S/C10H17N3O/c11-7-9-12-10(14-13-9)6-8-4-2-1-3-5-8/h8H,1-7,11H2
InChIKeyZFLPOFVNVKYXKE-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.65
Rot. Bonds3

About [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine

[5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine (PubChem CID 61326432) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine.

Molecular Properties

Compound Name[5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine
PubChem CID61326432
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name[5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine
SMILESNCc1noc(CC2CCCCC2)n1
InChIInChI=1S/C10H17N3O/c11-7-9-12-10(14-13-9)6-8-4-2-1-3-5-8/h8H,1-7,11H2
InChIKeyZFLPOFVNVKYXKE-UHFFFAOYSA-N
XLogP1.65
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine 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

5-(cycloheptylmethyl)-1,2,4-oxadiazol-3-amine
CID 114458859
[5-[(1-ethylpiperidin-3-yl)methyl]-1,2,4-oxadiazol-3-yl]methanamine
CID 115078590
5-(cycloheptylmethyl)-3-iodo-1,2,4-oxadiazole
CID 114458862
5-(cyclohexylmethyl)-3-methyl-1,2,4-oxadiazole
CID 127318368
1-[5-(cyclobutylmethyl)-1,2,4-oxadiazol-3-yl]-N-methylmethanamine
CID 104879933
2-[5-(2-cyclohexylethyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 61336068
N-[[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-1-cyclohexyl-N-(cyclohexylmethyl)methanamine
CID 120751413
1-[5-(cyclopentylmethyl)-1,2,4-oxadiazol-3-yl]cycloheptan-1-amine;hydrochloride
CID 71757439
2-[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,2,4-oxadiazol-3-yl]ethanamine
CID 115077578
2-amino-2-[5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 104633268
N-[[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-2-cyclohexyl-N-methylethanamine;hydrochloride
CID 120751614
5-(cyclopentylmethyl)-1,2,4-oxadiazole-3-carboxylic acid
CID 63382576

Frequently Asked Questions

What is the IUPAC name of [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine?
The IUPAC name of [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine (CID 61326432) is [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine.
What is the SMILES notation for [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine?
The canonical SMILES for [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine is NCc1noc(CC2CCCCC2)n1.
What is the InChIKey of [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine?
The InChIKey is ZFLPOFVNVKYXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c11-7-9-12-10(14-13-9)6-8-4-2-1-3-5-8/h8H,1-7,11H2.
What are the key properties of [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine?
[5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine has a molecular weight of 195.27 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclohexylmethyl)-1,2,4-oxadiazol-3-yl]methanamine is sourced from PubChem (CID 61326432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).