2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide

C15H25N3O3 — CID 54090471

IUPAC2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide
SMILESCNC(=O)CC1CCCN(C2CCN(C(C)=O)CC2)C1=O
InChIInChI=1S/C15H25N3O3/c1-11(19)17-8-5-13(6-9-17)18-7-3-4-12(15(18)21)10-14(20)16-2/h12-13H,3-10H2,1-2H3,(H,16,20)
InChIKeyMTMNUDSSHZXOPW-UHFFFAOYSA-N
MW295.38 g/mol
LogP0.37
Rot. Bonds3

About 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide

2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide (PubChem CID 54090471) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide.

Molecular Properties

Compound Name2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide
PubChem CID54090471
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide
SMILESCNC(=O)CC1CCCN(C2CCN(C(C)=O)CC2)C1=O
InChIInChI=1S/C15H25N3O3/c1-11(19)17-8-5-13(6-9-17)18-7-3-4-12(15(18)21)10-14(20)16-2/h12-13H,3-10H2,1-2H3,(H,16,20)
InChIKeyMTMNUDSSHZXOPW-UHFFFAOYSA-N
XLogP0.37
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-butyryl-4-piperidinyl)-N-cyclopropylpropanamide
CID 24816634
1-acetyl-N-(1-propylpiperidin-4-yl)piperidine-4-carboxamide
CID 6467229
N-(2-{1-[(1-cyclopentyl-6-oxo-3-piperidinyl)carbonyl]-4-piperidinyl}ethyl)acetamide
CID 24817555
1-(4-methylpiperidin-1-yl)sulfonyl-N-propan-2-ylpiperidine-3-carboxamide
CID 5123122
N-(1-methylpiperidin-4-yl)cyclohexanecarboxamide
CID 10775538
4-Methyl-1-(piperidine-3-carbonyl)piperidine hydrochloride
CID 2794684
2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-propan-2-ylacetamide
CID 11911992
2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide
CID 11912296
2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-propan-2-ylacetamide
CID 46295192
2-(1-Cyclohexanecarbonylpiperidin-4-YL)-N-[3-(2-methylpiperidin-1-YL)propyl]acetamide
CID 46295226
2-(1-Cyclohexanecarbonylpiperidin-4-YL)-N-[3-(3-methylpiperidin-1-YL)propyl]acetamide
CID 46295236
9-Methyl-2,9-diazaspiro[5.5]undecan-1-one
CID 51342118

Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide?
The IUPAC name of 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide (CID 54090471) is 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide.
What is the SMILES notation for 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide?
The canonical SMILES for 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide is CNC(=O)CC1CCCN(C2CCN(C(C)=O)CC2)C1=O.
What is the InChIKey of 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide?
The InChIKey is MTMNUDSSHZXOPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-11(19)17-8-5-13(6-9-17)18-7-3-4-12(15(18)21)10-14(20)16-2/h12-13H,3-10H2,1-2H3,(H,16,20).
What are the key properties of 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide?
2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide has a molecular weight of 295.38 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-acetylpiperidin-4-yl)-2-oxopiperidin-3-yl]-N-methylacetamide is sourced from PubChem (CID 54090471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).