2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole

C11H18N4O — CID 82473056

IUPAC2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole
SMILESC1CNCC(c2nnc(N3CCCC3)o2)C1
InChIInChI=1S/C11H18N4O/c1-2-7-15(6-1)11-14-13-10(16-11)9-4-3-5-12-8-9/h9,12H,1-8H2
InChIKeyLDWISIGAUMVPQR-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.14
Rot. Bonds2

About 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole

2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole (PubChem CID 82473056) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole
PubChem CID82473056
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole
SMILESC1CNCC(c2nnc(N3CCCC3)o2)C1
InChIInChI=1S/C11H18N4O/c1-2-7-15(6-1)11-14-13-10(16-11)9-4-3-5-12-8-9/h9,12H,1-8H2
InChIKeyLDWISIGAUMVPQR-UHFFFAOYSA-N
XLogP1.14
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-piperidin-3-yl-1,3,4-oxadiazole-2-carbaldehyde
CID 82668755
2-[(3S)-piperidin-3-yl]-5-propan-2-yl-1,3,4-oxadiazole
CID 96656863
1-[(3S)-3-[5-[(3S)-piperidin-3-yl]-1,3,4-oxadiazol-2-yl]piperidin-1-yl]propan-1-one
CID 124956744
N-tert-butyl-5-piperidin-3-yl-1,3,4-oxadiazol-2-amine
CID 110456060
2-(4-methylphenyl)-5-[(3S)-piperidin-3-yl]-1,3,4-oxadiazole
CID 39347689
2-piperidin-3-yl-5-(1,2,3,6-tetrahydropyridin-3-yl)-1,3,4-oxadiazole
CID 5255005
methyl 5-piperidin-3-yl-1,3,4-oxadiazole-2-carboxylate
CID 105464818
2-(azepan-3-yl)-5-ethyl-1,3,4-oxadiazole
CID 84666395
2-piperidin-1-yl-5-piperidin-3-yl-1,3,4-thiadiazole
CID 82481560
3-methyl-1-[(2S)-2-[5-[(3S)-piperidin-3-yl]-1,3,4-oxadiazol-2-yl]piperidin-1-yl]butan-1-one
CID 124952637
2-(3-bromophenyl)-5-piperidin-3-yl-1,3,4-oxadiazole
CID 82045304
2-(2-methoxyphenyl)-5-piperidin-3-yl-1,3,4-oxadiazole
CID 82044862

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole?
The IUPAC name of 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole (CID 82473056) is 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole is C1CNCC(c2nnc(N3CCCC3)o2)C1.
What is the InChIKey of 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole?
The InChIKey is LDWISIGAUMVPQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-2-7-15(6-1)11-14-13-10(16-11)9-4-3-5-12-8-9/h9,12H,1-8H2.
What are the key properties of 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole?
2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole has a molecular weight of 222.29 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-3-yl-5-pyrrolidin-1-yl-1,3,4-oxadiazole is sourced from PubChem (CID 82473056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).