2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine

C12H21N3O — CID 65222397

IUPAC2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
SMILESCCCC(CN)c1nc(C2CCCC2)no1
InChIInChI=1S/C12H21N3O/c1-2-5-10(8-13)12-14-11(15-16-12)9-6-3-4-7-9/h9-10H,2-8,13H2,1H3
InChIKeyUUDBDQDWGHGXRL-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.57
Rot. Bonds5

About 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine

2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine (PubChem CID 65222397) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine.

Molecular Properties

Compound Name2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
PubChem CID65222397
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
SMILESCCCC(CN)c1nc(C2CCCC2)no1
InChIInChI=1S/C12H21N3O/c1-2-5-10(8-13)12-14-11(15-16-12)9-6-3-4-7-9/h9-10H,2-8,13H2,1H3
InChIKeyUUDBDQDWGHGXRL-UHFFFAOYSA-N
XLogP2.57
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 65414302
2-[3-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 79077765
(1S)-3-amino-1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)propan-1-ol
CID 107836745
2-(3-methyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
CID 65223012
N-[1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]propan-1-amine
CID 63349207
2-[3-(4-ethylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 79666401
5-(1-bromopropyl)-3-cyclohexyl-1,2,4-oxadiazole
CID 62854721
(1S,2R)-1-amino-1-(3-cycloheptyl-1,2,4-oxadiazol-5-yl)propan-2-ol
CID 104965493
ethyl 2-(3-cyclohexyl-1,2,4-oxadiazol-5-yl)-4-methylpentanoate
CID 79481205
(1S)-1-[3-(oxan-3-yl)-1,2,4-oxadiazol-5-yl]butan-1-amine
CID 107565376
(1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine
CID 104880933
(1S)-1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-2,2-dimethylpropan-1-amine
CID 93357432

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The IUPAC name of 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine (CID 65222397) is 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine.
What is the SMILES notation for 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The canonical SMILES for 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine is CCCC(CN)c1nc(C2CCCC2)no1.
What is the InChIKey of 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The InChIKey is UUDBDQDWGHGXRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-2-5-10(8-13)12-14-11(15-16-12)9-6-3-4-7-9/h9-10H,2-8,13H2,1H3.
What are the key properties of 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)pentan-1-amine is sourced from PubChem (CID 65222397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).