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

C10H16N4O2 — CID 106408300

IUPAC3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
SMILESCCNC1CCCN(Cc2ncon2)C1=O
InChIInChI=1S/C10H16N4O2/c1-2-11-8-4-3-5-14(10(8)15)6-9-12-7-16-13-9/h7-8,11H,2-6H2,1H3
InChIKeyKTTSBGMHQSFFQF-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.17
Rot. Bonds4

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

3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one (PubChem CID 106408300) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one.

Molecular Properties

Compound Name3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
PubChem CID106408300
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
SMILESCCNC1CCCN(Cc2ncon2)C1=O
InChIInChI=1S/C10H16N4O2/c1-2-11-8-4-3-5-14(10(8)15)6-9-12-7-16-13-9/h7-8,11H,2-6H2,1H3
InChIKeyKTTSBGMHQSFFQF-UHFFFAOYSA-N
XLogP0.17
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
CID 106408298
3-(methylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)pyrrolidin-2-one
CID 106402196
3-(ethylamino)-1-(1,2-oxazol-5-ylmethyl)piperidin-2-one
CID 106421364
7-methyl-6-(methylamino)-4-(1,2,4-oxadiazol-3-ylmethyl)-1,4-oxazepan-5-one
CID 20590296
3-(ethylamino)-1-[(5-methylthiophen-2-yl)methyl]pyrrolidin-2-one
CID 62054329
3-(ethylamino)-1-(2-hydroxy-2-methylbutyl)piperidin-2-one
CID 65112678
N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide
CID 123875795
3-(methylamino)-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-2-one
CID 106408287
1-[2-(5-chlorothiophen-2-yl)ethyl]-3-(ethylamino)piperidin-2-one
CID 114139676
3-(ethylamino)-1-[(1-hydroxycycloheptyl)methyl]piperidin-2-one
CID 65122174
3-(methylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)-7-phenylazepan-2-one
CID 20798960
3-(cyclopropylamino)-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-2-one
CID 114185131

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one?
The IUPAC name of 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one (CID 106408300) is 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one.
What is the SMILES notation for 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one?
The canonical SMILES for 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one is CCNC1CCCN(Cc2ncon2)C1=O.
What is the InChIKey of 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one?
The InChIKey is KTTSBGMHQSFFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-2-11-8-4-3-5-14(10(8)15)6-9-12-7-16-13-9/h7-8,11H,2-6H2,1H3.
What are the key properties of 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one?
3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one has a molecular weight of 224.26 g/mol, XLogP of 0.17, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one is sourced from PubChem (CID 106408300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).