5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one

C24H34N4O4 — CID 45219929

IUPAC5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one
SMILESCC(=O)c1ccc(N2CCN(C(=O)C3CCC(=O)N(CCN4CCOCC4)C3)CC2)cc1
InChIInChI=1S/C24H34N4O4/c1-19(29)20-2-5-22(6-3-20)26-10-12-27(13-11-26)24(31)21-4-7-23(30)28(18-21)9-8-25-14-16-32-17-15-25/h2-3,5-6,21H,4,7-18H2,1H3
InChIKeyJATXCKCAMFZSQO-UHFFFAOYSA-N
MW442.56 g/mol
LogP1.11
Rot. Bonds6

About 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one

5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one (PubChem CID 45219929) has the molecular formula C24H34N4O4 and a molecular weight of 442.56 g/mol. Its IUPAC name is 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one.

Molecular Properties

Compound Name5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one
PubChem CID45219929
Molecular FormulaC24H34N4O4
Molecular Weight442.56 g/mol
Exact Mass442.26
IUPAC Name5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one
SMILESCC(=O)c1ccc(N2CCN(C(=O)C3CCC(=O)N(CCN4CCOCC4)C3)CC2)cc1
InChIInChI=1S/C24H34N4O4/c1-19(29)20-2-5-22(6-3-20)26-10-12-27(13-11-26)24(31)21-4-7-23(30)28(18-21)9-8-25-14-16-32-17-15-25/h2-3,5-6,21H,4,7-18H2,1H3
InChIKeyJATXCKCAMFZSQO-UHFFFAOYSA-N
XLogP1.11
TPSA73.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.56
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one with MolForge

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Related Compounds

(5S)-5-(4-acetyl-4-phenylpiperidine-1-carbonyl)-1-(2-morpholin-4-ylethyl)piperidin-2-one
CID 29087489
1-[4-[4-(4-morpholin-4-ylphenyl)piperazin-1-yl]phenyl]ethanone
CID 20729332
(5R)-1-ethyl-5-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]piperidin-2-one
CID 97136809
5-[4-(2,6-dimethyl-4-pyridinyl)piperazine-1-carbonyl]-1-(2-methoxyethyl)piperidin-2-one
CID 45192162
(3R)-N-(2-methylsulfanylethyl)-1-(2-morpholin-4-ylethyl)-6-oxopiperidine-3-carboxamide
CID 30853089
(5S)-5-(4-acetylpiperazine-1-carbonyl)-1-[2-(4-methoxyphenyl)ethyl]piperidin-2-one
CID 26334745
5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one
CID 24791970
1-[4-(4-acetylphenyl)piperazin-1-yl]-2-bromoethanone
CID 63681378
(1R,2S,3S,4R)-3-[4-(4-acetylphenyl)piperazine-1-carbonyl]bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
CID 98299268
N-(2-morpholin-4-ylethyl)-4-(4-pyrrolidin-1-ylphenyl)piperazine-1-carboxamide
CID 113106083
4-[4-[(2S)-1-methyl-5-oxopyrrolidine-2-carbonyl]piperazin-1-yl]benzamide
CID 136580851
N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide
CID 31932540

Frequently Asked Questions

What is the IUPAC name of 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one?
The IUPAC name of 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one (CID 45219929) is 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one.
What is the SMILES notation for 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one?
The canonical SMILES for 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one is CC(=O)c1ccc(N2CCN(C(=O)C3CCC(=O)N(CCN4CCOCC4)C3)CC2)cc1.
What is the InChIKey of 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one?
The InChIKey is JATXCKCAMFZSQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N4O4/c1-19(29)20-2-5-22(6-3-20)26-10-12-27(13-11-26)24(31)21-4-7-23(30)28(18-21)9-8-25-14-16-32-17-15-25/h2-3,5-6,21H,4,7-18H2,1H3.
What are the key properties of 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one?
5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one has a molecular weight of 442.56 g/mol, XLogP of 1.11, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ylethyl)piperidin-2-one is sourced from PubChem (CID 45219929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).