4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide

C15H24N4O5 — CID 78524418

IUPAC4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide
SMILESCOCC(=O)N1CCN(C(C)=O)CC1C(=O)NC1CCCNC1=O
InChIInChI=1S/C15H24N4O5/c1-10(20)18-6-7-19(13(21)9-24-2)12(8-18)15(23)17-11-4-3-5-16-14(11)22/h11-12H,3-9H2,1-2H3,(H,16,22)(H,17,23)
InChIKeyHIKHYKQBWXLKJE-UHFFFAOYSA-N
MW340.38 g/mol
LogP-1.91
Rot. Bonds4

About 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide

4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide (PubChem CID 78524418) has the molecular formula C15H24N4O5 and a molecular weight of 340.38 g/mol. Its IUPAC name is 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide.

Molecular Properties

Compound Name4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide
PubChem CID78524418
Molecular FormulaC15H24N4O5
Molecular Weight340.38 g/mol
Exact Mass340.17
IUPAC Name4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide
SMILESCOCC(=O)N1CCN(C(C)=O)CC1C(=O)NC1CCCNC1=O
InChIInChI=1S/C15H24N4O5/c1-10(20)18-6-7-19(13(21)9-24-2)12(8-18)15(23)17-11-4-3-5-16-14(11)22/h11-12H,3-9H2,1-2H3,(H,16,22)(H,17,23)
InChIKeyHIKHYKQBWXLKJE-UHFFFAOYSA-N
XLogP-1.91
TPSA108.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 5-1.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-1-(2-methoxyacetyl)-4-(4-methoxybenzoyl)-N-[(3R)-2-oxopiperidin-3-yl]piperazine-2-carboxamide
CID 163097256
(2R)-4-(2-methoxyacetyl)-N-[(3R)-2-oxopiperidin-3-yl]-1-(pyrimidine-5-carbonyl)piperazine-2-carboxamide
CID 163158475
(2S)-1-[4-(dimethylamino)benzoyl]-4-(2-methoxyacetyl)-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide
CID 11911666
(2S)-4-(2-methoxyacetyl)-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide
CID 9423832
(2R)-1-(2-aminoacetyl)-4-(4-methoxybenzoyl)-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide
CID 7682218
(2S)-1-acetyl-N-[(3S)-2-oxopiperidin-3-yl]-4-(pyrimidine-5-carbonyl)piperazine-2-carboxamide
CID 11912338
1-acetyl-N-(2-oxopiperidin-3-yl)-4-(1,3-thiazolidine-4-carbonyl)piperazine-2-carboxamide
CID 73148897
(2S)-1,4-bis(cyclohexanecarbonyl)-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide
CID 9419644
5-oxo-5-[(2R)-2-[[(3S)-2-oxopiperidin-3-yl]carbamoyl]-4-(phenylcarbamoyl)piperazin-1-yl]pentanoic acid
CID 40534565
4-(cyclohexanecarbonyl)-1-N-cyclohexyl-3-N-(2-oxopiperidin-3-yl)piperazine-1,3-dicarboxamide
CID 73139978
(3S)-4-benzoyl-3-N-[(3S)-2-oxopiperidin-3-yl]-1-N-propan-2-ylpiperazine-1,3-dicarboxamide
CID 7682191
(3R)-1-N-cyclohexyl-4-(4-methoxybenzoyl)-3-N-[(3S)-2-oxopiperidin-3-yl]piperazine-1,3-dicarboxamide
CID 11912207

Frequently Asked Questions

What is the IUPAC name of 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide?
The IUPAC name of 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide (CID 78524418) is 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide.
What is the SMILES notation for 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide?
The canonical SMILES for 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide is COCC(=O)N1CCN(C(C)=O)CC1C(=O)NC1CCCNC1=O.
What is the InChIKey of 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide?
The InChIKey is HIKHYKQBWXLKJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O5/c1-10(20)18-6-7-19(13(21)9-24-2)12(8-18)15(23)17-11-4-3-5-16-14(11)22/h11-12H,3-9H2,1-2H3,(H,16,22)(H,17,23).
What are the key properties of 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide?
4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide has a molecular weight of 340.38 g/mol, XLogP of -1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetyl-1-(2-methoxyacetyl)-N-(2-oxopiperidin-3-yl)piperazine-2-carboxamide is sourced from PubChem (CID 78524418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).