4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one

C23H31N3O4 — CID 134797290

IUPAC4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one
SMILESCc1ccc(C(=O)N2CCC(C(=O)N3CCC(N4CCOCC4=O)CC3)CC2)cc1
InChIInChI=1S/C23H31N3O4/c1-17-2-4-18(5-3-17)22(28)24-10-6-19(7-11-24)23(29)25-12-8-20(9-13-25)26-14-15-30-16-21(26)27/h2-5,19-20H,6-16H2,1H3
InChIKeyTVGNIQMSDRICSV-UHFFFAOYSA-N
MW413.52 g/mol
LogP1.70
Rot. Bonds3

About 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one

4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one (PubChem CID 134797290) has the molecular formula C23H31N3O4 and a molecular weight of 413.52 g/mol. Its IUPAC name is 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one.

Molecular Properties

Compound Name4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one
PubChem CID134797290
Molecular FormulaC23H31N3O4
Molecular Weight413.52 g/mol
Exact Mass413.23
IUPAC Name4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one
SMILESCc1ccc(C(=O)N2CCC(C(=O)N3CCC(N4CCOCC4=O)CC3)CC2)cc1
InChIInChI=1S/C23H31N3O4/c1-17-2-4-18(5-3-17)22(28)24-10-6-19(7-11-24)23(29)25-12-8-20(9-13-25)26-14-15-30-16-21(26)27/h2-5,19-20H,6-16H2,1H3
InChIKeyTVGNIQMSDRICSV-UHFFFAOYSA-N
XLogP1.70
TPSA70.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.52
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one 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

4-[1-[1-(4-fluorobenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one
CID 134797710
3-[1-(4-methylbenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one
CID 110710655
N-(4-methylphenyl)-3-[4-(3-oxomorpholin-4-yl)piperidine-1-carbonyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 143232706
cyclohexyl-[4-(4-methylbenzoyl)piperazin-1-yl]methanone
CID 110346969
[1-(4-methylbenzoyl)piperidin-4-yl]-(4-methyl-1,4-diazepan-1-yl)methanone
CID 118775973
4-[4-(4-methylbenzoyl)piperazine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 120672880
[1-(4-methylbenzoyl)piperidin-4-yl]-(4-methylphenyl)methanone
CID 2741000
cyclohexyl-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]methanone
CID 110797446
[1-(4-methylbenzoyl)piperidin-4-yl]-[(2R)-2-methylpiperidin-1-yl]methanone
CID 94861219
1-[4-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 46564409
morpholin-4-yl-[1-[1-[4-(trifluoromethyl)benzoyl]piperidine-4-carbonyl]piperidin-4-yl]methanone
CID 32651661
[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 38491417

Frequently Asked Questions

What is the IUPAC name of 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one?
The IUPAC name of 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one (CID 134797290) is 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one.
What is the SMILES notation for 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one?
The canonical SMILES for 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one is Cc1ccc(C(=O)N2CCC(C(=O)N3CCC(N4CCOCC4=O)CC3)CC2)cc1.
What is the InChIKey of 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one?
The InChIKey is TVGNIQMSDRICSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O4/c1-17-2-4-18(5-3-17)22(28)24-10-6-19(7-11-24)23(29)25-12-8-20(9-13-25)26-14-15-30-16-21(26)27/h2-5,19-20H,6-16H2,1H3.
What are the key properties of 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one?
4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one has a molecular weight of 413.52 g/mol, XLogP of 1.70, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[1-(4-methylbenzoyl)piperidine-4-carbonyl]piperidin-4-yl]morpholin-3-one is sourced from PubChem (CID 134797290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).