2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol

C9H15N3O2 — CID 104827152

IUPAC2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol
SMILESNC1CCCC1c1nc(CCO)no1
InChIInChI=1S/C9H15N3O2/c10-7-3-1-2-6(7)9-11-8(4-5-13)12-14-9/h6-7,13H,1-5,10H2
InChIKeyGBPMOGICWKLIJK-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.20
Rot. Bonds3

About 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol

2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol (PubChem CID 104827152) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol.

Molecular Properties

Compound Name2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol
PubChem CID104827152
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol
SMILESNC1CCCC1c1nc(CCO)no1
InChIInChI=1S/C9H15N3O2/c10-7-3-1-2-6(7)9-11-8(4-5-13)12-14-9/h6-7,13H,1-5,10H2
InChIKeyGBPMOGICWKLIJK-UHFFFAOYSA-N
XLogP0.20
TPSA85.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-(2,2-dimethylpropyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 63892405
2-[3-(3-methylbutyl)-1,2,4-oxadiazol-5-yl]cyclohexan-1-amine
CID 63350639
2-[3-(methylsulfonylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 63352505
2-[3-[(dimethylamino)methyl]-1,2,4-oxadiazol-5-yl]cyclohexan-1-amine
CID 79077058
2-[3-(propan-2-ylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 65134199
2-[5-(3-aminocyclohexyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 104826978
2-[3-[2-(2,2,2-trifluoroethoxy)ethyl]-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 103146144
2-[3-[(2-methylphenyl)methyl]-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 63350963
2-[3-(2-methylpropylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]cycloheptan-1-amine
CID 65136880
2-[3-[(2-methylphenyl)methyl]-1,2,4-oxadiazol-5-yl]cyclohexan-1-amine
CID 63351048
5-(2-aminocyclopentyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791399
2-(3-cycloheptyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
CID 65390691

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol?
The IUPAC name of 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol (CID 104827152) is 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol.
What is the SMILES notation for 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol?
The canonical SMILES for 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol is NC1CCCC1c1nc(CCO)no1.
What is the InChIKey of 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol?
The InChIKey is GBPMOGICWKLIJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c10-7-3-1-2-6(7)9-11-8(4-5-13)12-14-9/h6-7,13H,1-5,10H2.
What are the key properties of 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol?
2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol has a molecular weight of 197.24 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-aminocyclopentyl)-1,2,4-oxadiazol-3-yl]ethanol is sourced from PubChem (CID 104827152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).