1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine

C14H24N4O — CID 107182992

IUPAC1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine
SMILESCC1CCCC1c1nc(C(N)CN2CCCC2)no1
InChIInChI=1S/C14H24N4O/c1-10-5-4-6-11(10)14-16-13(17-19-14)12(15)9-18-7-2-3-8-18/h10-12H,2-9,15H2,1H3
InChIKeyHJOBEOOKCRDWKK-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.07
Rot. Bonds4

About 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine

1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine (PubChem CID 107182992) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine.

Molecular Properties

Compound Name1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine
PubChem CID107182992
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine
SMILESCC1CCCC1c1nc(C(N)CN2CCCC2)no1
InChIInChI=1S/C14H24N4O/c1-10-5-4-6-11(10)14-16-13(17-19-14)12(15)9-18-7-2-3-8-18/h10-12H,2-9,15H2,1H3
InChIKeyHJOBEOOKCRDWKK-UHFFFAOYSA-N
XLogP2.07
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-methyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine
CID 104635946
1-[5-(1,1-dioxothiolan-3-yl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine
CID 104635792
1-[5-(2-bicyclo[2.2.1]heptanyl)-1,2,4-oxadiazol-3-yl]-2-morpholin-4-ylethanamine
CID 104636104
1-(5-pentan-3-yl-1,2,4-oxadiazol-3-yl)-2-pyrrolidin-1-ylethanamine
CID 104635871
1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine
CID 104635994
1-(5-ethoxy-1,2,4-oxadiazol-3-yl)-2-pyrrolidin-1-ylethanamine
CID 104635764
1-(5-heptan-4-yl-1,2,4-oxadiazol-3-yl)-2-pyrrolidin-1-ylethanamine
CID 104635935
1-(5-butan-2-yl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine
CID 113435612
2-morpholin-4-yl-1-[5-(oxan-3-yl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 104636221
1-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-2-piperidin-1-ylethanamine
CID 104636055
1-[5-(1-methylcyclohexyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine
CID 106828772
2-morpholin-4-yl-1-[5-(thiolan-3-yl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 104636222

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine?
The IUPAC name of 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine (CID 107182992) is 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine.
What is the SMILES notation for 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine?
The canonical SMILES for 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine is CC1CCCC1c1nc(C(N)CN2CCCC2)no1.
What is the InChIKey of 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine?
The InChIKey is HJOBEOOKCRDWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10-5-4-6-11(10)14-16-13(17-19-14)12(15)9-18-7-2-3-8-18/h10-12H,2-9,15H2,1H3.
What are the key properties of 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine?
1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine has a molecular weight of 264.37 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-methylcyclopentyl)-1,2,4-oxadiazol-3-yl]-2-pyrrolidin-1-ylethanamine is sourced from PubChem (CID 107182992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).