1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one

C17H29N3O3 — CID 20590481

IUPAC1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one
SMILESCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1
InChIInChI=1S/C17H29N3O3/c1-18-7-4-15(5-8-18)20-6-2-3-14(17(20)22)13-16(21)19-9-11-23-12-10-19/h14-15H,2-13H2,1H3
InChIKeyDMRIHQZPHUNVAT-UHFFFAOYSA-N
MW323.44 g/mol
LogP0.57
Rot. Bonds3

About 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one

1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one (PubChem CID 20590481) has the molecular formula C17H29N3O3 and a molecular weight of 323.44 g/mol. Its IUPAC name is 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one.

Molecular Properties

Compound Name1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one
PubChem CID20590481
Molecular FormulaC17H29N3O3
Molecular Weight323.44 g/mol
Exact Mass323.22
IUPAC Name1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one
SMILESCN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1
InChIInChI=1S/C17H29N3O3/c1-18-7-4-15(5-8-18)20-6-2-3-14(17(20)22)13-16(21)19-9-11-23-12-10-19/h14-15H,2-13H2,1H3
InChIKeyDMRIHQZPHUNVAT-UHFFFAOYSA-N
XLogP0.57
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]-1-morpholin-4-ylethanone
CID 11912300
1-[4-[4-(Morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]pentan-1-one
CID 42693441
Cyclohexyl-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]methanone
CID 42693449
Cyclopropyl-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]methanone
CID 42693450
3,3-Dimethyl-1-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]butan-1-one
CID 42693454
Cyclohexyl[2-(2-morpholinoethyl)piperidino]methanone
CID 53193420
4-[1-[1-(2-Methoxyacetyl)piperidine-3-carbonyl]piperidin-4-yl]morpholin-3-one
CID 134799489
1'-(3-Cyclopentylpropyl)-4-(4-morpholinylcarbonyl)-1,4'-bipiperidine
CID 45929210
1-[3-[2-(Morpholine-4-carbonyl)piperidine-1-carbonyl]piperidin-1-yl]butan-1-one
CID 127284451
N-(2-methoxyethyl)-N-(1-methylpiperidin-4-yl)-4-(4-methylpiperidin-1-yl)-4-oxobutanamide
CID 4102327
1'-[(1-Methylcyclohexyl)carbonyl]-4-(4-morpholinylcarbonyl)-1,4'-bipiperidine
CID 25375245
1'-(Cyclohexylmethyl)-4-(4-morpholinylcarbonyl)-1,4'-bipiperidine
CID 25447022

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one?
The IUPAC name of 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one (CID 20590481) is 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one.
What is the SMILES notation for 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one?
The canonical SMILES for 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one is CN1CCC(N2CCCC(CC(=O)N3CCOCC3)C2=O)CC1.
What is the InChIKey of 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one?
The InChIKey is DMRIHQZPHUNVAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O3/c1-18-7-4-15(5-8-18)20-6-2-3-14(17(20)22)13-16(21)19-9-11-23-12-10-19/h14-15H,2-13H2,1H3.
What are the key properties of 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one?
1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one has a molecular weight of 323.44 g/mol, XLogP of 0.57, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpiperidin-4-yl)-3-(2-morpholin-4-yl-2-oxoethyl)piperidin-2-one is sourced from PubChem (CID 20590481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).