5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one

C12H21N3O3 — CID 81484363

IUPAC5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one
SMILESCC(N)C1CN(C(=O)C2CCC(=O)NC2)CCO1
InChIInChI=1S/C12H21N3O3/c1-8(13)10-7-15(4-5-18-10)12(17)9-2-3-11(16)14-6-9/h8-10H,2-7,13H2,1H3,(H,14,16)
InChIKeyPKOIYRNVIHZNIV-UHFFFAOYSA-N
MW255.32 g/mol
LogP-0.91
Rot. Bonds2

About 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one

5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one (PubChem CID 81484363) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one.

Molecular Properties

Compound Name5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one
PubChem CID81484363
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC Name5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one
SMILESCC(N)C1CN(C(=O)C2CCC(=O)NC2)CCO1
InChIInChI=1S/C12H21N3O3/c1-8(13)10-7-15(4-5-18-10)12(17)9-2-3-11(16)14-6-9/h8-10H,2-7,13H2,1H3,(H,14,16)
InChIKeyPKOIYRNVIHZNIV-UHFFFAOYSA-N
XLogP-0.91
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(1-aminoethyl)morpholin-4-yl]-(1-methylpyrrolidin-3-yl)methanone
CID 115315156
methyl 2-[4-(6-oxopiperidine-3-carbonyl)morpholin-2-yl]acetate
CID 79807210
[2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone
CID 81485314
(5S)-5-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]piperidin-2-one
CID 94159203
5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one
CID 103745537
[2-(1-aminoethyl)morpholin-4-yl]-(6-bicyclo[3.1.0]hexanyl)methanone
CID 81484253
[2-(1-aminoethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone
CID 115315098
5-(azepane-1-carbonyl)piperidin-2-one
CID 112728735
5-(azocane-1-carbonyl)piperidin-2-one
CID 112728799
[2-(1-aminoethyl)morpholin-4-yl]-(oxan-2-yl)methanone
CID 113285006
2-amino-1-[2-(1-aminoethyl)morpholin-4-yl]propan-1-one
CID 131134178
4-[4-(1-aminoethyl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 81478905

Frequently Asked Questions

What is the IUPAC name of 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one?
The IUPAC name of 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one (CID 81484363) is 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one.
What is the SMILES notation for 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one?
The canonical SMILES for 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one is CC(N)C1CN(C(=O)C2CCC(=O)NC2)CCO1.
What is the InChIKey of 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one?
The InChIKey is PKOIYRNVIHZNIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c1-8(13)10-7-15(4-5-18-10)12(17)9-2-3-11(16)14-6-9/h8-10H,2-7,13H2,1H3,(H,14,16).
What are the key properties of 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one?
5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one has a molecular weight of 255.32 g/mol, XLogP of -0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one is sourced from PubChem (CID 81484363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).