N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine

C11H19N3O — CID 62343969

IUPACN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine
SMILESCC(C)NCc1noc(C2CCCC2)n1
InChIInChI=1S/C11H19N3O/c1-8(2)12-7-10-13-11(15-14-10)9-5-3-4-6-9/h8-9,12H,3-7H2,1-2H3
InChIKeyJQRHHQZBPAEDBV-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.23
Rot. Bonds4

About N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine

N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine (PubChem CID 62343969) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine
PubChem CID62343969
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine
SMILESCC(C)NCc1noc(C2CCCC2)n1
InChIInChI=1S/C11H19N3O/c1-8(2)12-7-10-13-11(15-14-10)9-5-3-4-6-9/h8-9,12H,3-7H2,1-2H3
InChIKeyJQRHHQZBPAEDBV-UHFFFAOYSA-N
XLogP2.23
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-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

Related Compounds

N-[(5-cyclohexyl-1,2,4-oxadiazol-3-yl)methyl]ethanamine
CID 62342162
N-[[5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-oxadiazol-3-yl]methyl]propan-2-amine
CID 66478393
(2R)-N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-1-(3,5-dimethylpyrazol-1-yl)propan-2-amine
CID 95197767
2-[(5-cyclohexyl-1,2,4-oxadiazol-3-yl)methylamino]-2-methylpropane-1,3-diol
CID 75436511
(2S,3R)-N-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-3-(4-methylpyrazol-1-yl)butan-2-amine
CID 95302392
N-[[1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-3,5-dimethylpyrazol-4-yl]methyl]propan-2-amine
CID 61495486
N-[[5-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]-2-pyridinyl]methyl]propan-2-amine
CID 79782731
2-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)-N-methylacetamide
CID 71970446
3-(chloromethyl)-5-cyclohexyl-1,2,4-oxadiazole;N-methylformamide
CID 145398456
1-(2-methylphenyl)-N-[[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methyl]ethanamine
CID 84596270
cis-(1R,2S)-2-methyl-N-[[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methyl]cyclohexan-1-amine
CID 99716030
N-methyl-1-(5-piperidin-3-yl-1,2,4-oxadiazol-3-yl)methanamine
CID 115077717

Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine?
The IUPAC name of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine (CID 62343969) is N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine is CC(C)NCc1noc(C2CCCC2)n1.
What is the InChIKey of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine?
The InChIKey is JQRHHQZBPAEDBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8(2)12-7-10-13-11(15-14-10)9-5-3-4-6-9/h8-9,12H,3-7H2,1-2H3.
What are the key properties of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine?
N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine has a molecular weight of 209.29 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]propan-2-amine is sourced from PubChem (CID 62343969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).