3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one

C11H16N4O2 — CID 106408298

IUPAC3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
SMILESO=C1C(NC2CC2)CCCN1Cc1ncon1
InChIInChI=1S/C11H16N4O2/c16-11-9(13-8-3-4-8)2-1-5-15(11)6-10-12-7-17-14-10/h7-9,13H,1-6H2
InChIKeyWEPTXFNGQXXRKI-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.31
Rot. Bonds4

About 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one

3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one (PubChem CID 106408298) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one.

Molecular Properties

Compound Name3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
PubChem CID106408298
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
SMILESO=C1C(NC2CC2)CCCN1Cc1ncon1
InChIInChI=1S/C11H16N4O2/c16-11-9(13-8-3-4-8)2-1-5-15(11)6-10-12-7-17-14-10/h7-9,13H,1-6H2
InChIKeyWEPTXFNGQXXRKI-UHFFFAOYSA-N
XLogP0.31
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
CID 106408300
3-(cyclopropylamino)-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-2-one
CID 114185131
3-(methylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)pyrrolidin-2-one
CID 106402196
N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide
CID 123875795
3-(cyclopropylamino)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-2-one
CID 79238476
7-methyl-6-(methylamino)-4-(1,2,4-oxadiazol-3-ylmethyl)-1,4-oxazepan-5-one
CID 20590296
3-(cyclopropylamino)-1-[(1-methylcyclobutyl)methyl]piperidin-2-one
CID 114109373
3-(methylamino)-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-2-one
CID 106408287
N-cyclopropyl-3-[3-(cyclopropylamino)-2-oxopiperidin-1-yl]propanamide
CID 79400868
3-(cyclopropylamino)-1-[2-(1-methylpiperidin-4-yl)ethyl]piperidin-2-one
CID 114516757
3-(methylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)-7-phenylazepan-2-one
CID 20798960
3-(cyclopropylamino)-1-[3-(2-hydroxyethoxy)propyl]piperidin-2-one
CID 106305737

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one?
The IUPAC name of 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one (CID 106408298) is 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one.
What is the SMILES notation for 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one?
The canonical SMILES for 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one is O=C1C(NC2CC2)CCCN1Cc1ncon1.
What is the InChIKey of 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one?
The InChIKey is WEPTXFNGQXXRKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c16-11-9(13-8-3-4-8)2-1-5-15(11)6-10-12-7-17-14-10/h7-9,13H,1-6H2.
What are the key properties of 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one?
3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one has a molecular weight of 236.27 g/mol, XLogP of 0.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one is sourced from PubChem (CID 106408298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).