1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one

C12H21N3O2 — CID 64682024

IUPAC1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one
SMILESCN1CCN(C(=O)CC2CCCNC2)CC1=O
InChIInChI=1S/C12H21N3O2/c1-14-5-6-15(9-12(14)17)11(16)7-10-3-2-4-13-8-10/h10,13H,2-9H2,1H3
InChIKeyLOKGZADQKMYJCD-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.32
Rot. Bonds2

About 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one

1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one (PubChem CID 64682024) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one.

Molecular Properties

Compound Name1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one
PubChem CID64682024
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one
SMILESCN1CCN(C(=O)CC2CCCNC2)CC1=O
InChIInChI=1S/C12H21N3O2/c1-14-5-6-15(9-12(14)17)11(16)7-10-3-2-4-13-8-10/h10,13H,2-9H2,1H3
InChIKeyLOKGZADQKMYJCD-UHFFFAOYSA-N
XLogP-0.32
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(4-aminocyclohexyl)acetyl]-1-methylpiperazin-2-one
CID 64692911
4-[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]-1-methylpiperazin-2-one
CID 79614970
2-piperidin-3-yl-1-(3,3,4-trimethylpiperazin-1-yl)ethanone
CID 63634230
4-[2-[4-(aminomethyl)cyclohexyl]acetyl]-1-methyl-1,4-diazepan-2-one
CID 102892849
1-(4-methoxypiperidin-1-yl)-2-piperidin-3-ylethanone
CID 62690713
1-(3-ethylpiperidin-1-yl)-2-piperidin-3-ylethanone
CID 62689348
1-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]-2-piperidin-3-ylethanone
CID 107218340
2-piperidin-3-yl-1-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethanone
CID 63153568
1-(1-oxo-1,4-thiazinan-4-yl)-2-piperidin-3-ylethanone
CID 62691071
1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-piperidin-3-ylethanone
CID 106835886
1-(3-azaspiro[5.5]undecan-3-yl)-2-piperidin-3-ylethanone
CID 62932288
methyl 1-(2-piperidin-3-ylacetyl)piperidine-4-carboxylate
CID 62674333

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one?
The IUPAC name of 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one (CID 64682024) is 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one.
What is the SMILES notation for 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one?
The canonical SMILES for 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one is CN1CCN(C(=O)CC2CCCNC2)CC1=O.
What is the InChIKey of 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one?
The InChIKey is LOKGZADQKMYJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-14-5-6-15(9-12(14)17)11(16)7-10-3-2-4-13-8-10/h10,13H,2-9H2,1H3.
What are the key properties of 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one?
1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one has a molecular weight of 239.32 g/mol, XLogP of -0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-piperidin-3-ylacetyl)piperazin-2-one is sourced from PubChem (CID 64682024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).