[1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone

C17H20Cl2N2O3 — CID 51326639

IUPAC[1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(Cl)cc1Cl)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C17H20Cl2N2O3/c18-13-3-4-14(15(19)10-13)17(23)21-5-1-2-12(11-21)16(22)20-6-8-24-9-7-20/h3-4,10,12H,1-2,5-9,11H2
InChIKeyKUGXYKORNYLMMB-UHFFFAOYSA-N
MW371.26 g/mol
LogP2.70
Rot. Bonds2

About [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone

[1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone (PubChem CID 51326639) has the molecular formula C17H20Cl2N2O3 and a molecular weight of 371.26 g/mol. Its IUPAC name is [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
PubChem CID51326639
Molecular FormulaC17H20Cl2N2O3
Molecular Weight371.26 g/mol
Exact Mass370.09
IUPAC Name[1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(Cl)cc1Cl)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C17H20Cl2N2O3/c18-13-3-4-14(15(19)10-13)17(23)21-5-1-2-12(11-21)16(22)20-6-8-24-9-7-20/h3-4,10,12H,1-2,5-9,11H2
InChIKeyKUGXYKORNYLMMB-UHFFFAOYSA-N
XLogP2.70
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.26
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2-chloro-4-fluorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 51329356
methyl (3S)-1-(2,4-dichlorobenzoyl)piperidine-3-carboxylate
CID 78919345
5-chloro-3-[3-(morpholine-4-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 77090270
1-(2,4-dichlorobenzoyl)-N,N-diethylpiperidine-3-carboxamide
CID 42695501
[1-(5-chloro-2-hydroxybenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 51275657
morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone
CID 31006642
[3-(4-chlorophenyl)azepan-1-yl]-(2,4-dichlorophenyl)methanone
CID 121146499
[1-(2-chlorobenzoyl)piperidin-3-yl]-(4-phenylpiperazin-1-yl)methanone
CID 3436001
morpholin-4-yl-[1-[2-(trifluoromethyl)benzoyl]piperidin-3-yl]methanone
CID 55517643
(2,4-dichlorophenyl)-[(3R)-3-(trifluoromethyl)piperidin-1-yl]methanone
CID 7064237
[1-(4-aminobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 119700503
azepan-1-yl-[1-(3-chlorobenzoyl)piperidin-3-yl]methanone
CID 662429

Frequently Asked Questions

What is the IUPAC name of [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone (CID 51326639) is [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone is O=C(c1ccc(Cl)cc1Cl)N1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone?
The InChIKey is KUGXYKORNYLMMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20Cl2N2O3/c18-13-3-4-14(15(19)10-13)17(23)21-5-1-2-12(11-21)16(22)20-6-8-24-9-7-20/h3-4,10,12H,1-2,5-9,11H2.
What are the key properties of [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone?
[1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone has a molecular weight of 371.26 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-dichlorobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 51326639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).