3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one

C10H20N2O2 — CID 110838241

IUPAC3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one
SMILESCNC(C)(C)CC(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O2/c1-10(2,11-3)8-9(13)12-4-6-14-7-5-12/h11H,4-8H2,1-3H3
InChIKeyNJAISQRYKMJBGC-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.23
Rot. Bonds3

About 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one

3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one (PubChem CID 110838241) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one.

Molecular Properties

Compound Name3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one
PubChem CID110838241
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one
SMILESCNC(C)(C)CC(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O2/c1-10(2,11-3)8-9(13)12-4-6-14-7-5-12/h11H,4-8H2,1-3H3
InChIKeyNJAISQRYKMJBGC-UHFFFAOYSA-N
XLogP0.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-methyl-1-morpholin-4-ylbutan-1-one
CID 64685110
3,3-dimethyl-1-(1,4-oxazepan-4-yl)butan-1-one
CID 58395315
3,3-dimethyl-1-morpholin-4-ylbutan-1-one;N,N,3,3-tetramethylbutanamide
CID 167657660
ethane;2-methyl-2-(methylamino)-1-morpholin-4-ylpropan-1-one
CID 168940917
2-(3-methylpentan-3-ylamino)-1-morpholin-4-ylethanone
CID 103746720
2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
CID 47009992
2-methyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]propanamide
CID 61218287
3-[(3-hydroxy-2,2-dimethylpropyl)amino]-1-morpholin-4-ylpropan-1-one
CID 113411282
ethane;(2-morpholin-4-yl-2-oxoethyl)azanide;yttrium
CID 153399009
2-[methyl(methylaminomethyl)amino]-1-morpholin-4-ylethanone
CID 177179015
2-(2-amino-2-methylpropyl)sulfanyl-1-morpholin-4-ylethanone
CID 66231125
2-(4-tert-butylpiperazin-1-yl)-1-morpholin-4-ylethanone
CID 21061564

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one?
The IUPAC name of 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one (CID 110838241) is 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one.
What is the SMILES notation for 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one?
The canonical SMILES for 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one is CNC(C)(C)CC(=O)N1CCOCC1.
What is the InChIKey of 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one?
The InChIKey is NJAISQRYKMJBGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2,11-3)8-9(13)12-4-6-14-7-5-12/h11H,4-8H2,1-3H3.
What are the key properties of 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one?
3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one has a molecular weight of 200.28 g/mol, XLogP of 0.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-(methylamino)-1-morpholin-4-ylbutan-1-one is sourced from PubChem (CID 110838241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).