4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide

C12H25N3O2 — CID 66426517

IUPAC4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide
SMILESCCNC(=O)CC(CN)N1CCOCC1CC
InChIInChI=1S/C12H25N3O2/c1-3-10-9-17-6-5-15(10)11(8-13)7-12(16)14-4-2/h10-11H,3-9,13H2,1-2H3,(H,14,16)
InChIKeyQCJQTSOIPOSWPZ-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.05
Rot. Bonds6

About 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide

4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide (PubChem CID 66426517) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide.

Molecular Properties

Compound Name4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide
PubChem CID66426517
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide
SMILESCCNC(=O)CC(CN)N1CCOCC1CC
InChIInChI=1S/C12H25N3O2/c1-3-10-9-17-6-5-15(10)11(8-13)7-12(16)14-4-2/h10-11H,3-9,13H2,1-2H3,(H,14,16)
InChIKeyQCJQTSOIPOSWPZ-UHFFFAOYSA-N
XLogP-0.05
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-(3-ethylmorpholin-4-yl)-N-methylbutanamide
CID 66427985
2-(3-ethylmorpholin-4-yl)pentan-1-amine
CID 43612958
3-(3-ethylmorpholin-4-yl)pentanoic acid
CID 63069337
3-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl)-4-amino-N-ethylbutanamide
CID 66429077
4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide
CID 66432044
4-(1-aminopentan-3-yl)-N-ethylmorpholine-3-carboxamide
CID 83106656
3-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-4-amino-N-propylbutanamide
CID 66428466
4-amino-3-[3-(dimethylamino)piperidin-1-yl]-N-ethylbutanamide
CID 66426952
4-amino-N-propyl-3-(2-propylpiperidin-1-yl)butanamide
CID 83053457
4-amino-N-ethyl-3-(4-propylazepan-1-yl)butanamide
CID 66427386
2-(3-ethylmorpholin-4-yl)-N-propylbutan-1-amine
CID 62432044
3-(3-ethylmorpholin-4-yl)-N,2-dimethylbutan-1-amine
CID 79408287

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide?
The IUPAC name of 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide (CID 66426517) is 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide.
What is the SMILES notation for 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide?
The canonical SMILES for 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide is CCNC(=O)CC(CN)N1CCOCC1CC.
What is the InChIKey of 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide?
The InChIKey is QCJQTSOIPOSWPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-3-10-9-17-6-5-15(10)11(8-13)7-12(16)14-4-2/h10-11H,3-9,13H2,1-2H3,(H,14,16).
What are the key properties of 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide?
4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide has a molecular weight of 243.35 g/mol, XLogP of -0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-3-(3-ethylmorpholin-4-yl)butanamide is sourced from PubChem (CID 66426517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).