3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one

C10H20N2O2 — CID 110838021

IUPAC3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one
SMILESCNC(C(=O)N1CCOCC1)C(C)C
InChIInChI=1S/C10H20N2O2/c1-8(2)9(11-3)10(13)12-4-6-14-7-5-12/h8-9,11H,4-7H2,1-3H3
InChIKeyOBIBDUCBJNGTCR-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.09
Rot. Bonds3

About 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one

3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one (PubChem CID 110838021) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one.

Molecular Properties

Compound Name3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one
PubChem CID110838021
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one
SMILESCNC(C(=O)N1CCOCC1)C(C)C
InChIInChI=1S/C10H20N2O2/c1-8(2)9(11-3)10(13)12-4-6-14-7-5-12/h8-9,11H,4-7H2,1-3H3
InChIKeyOBIBDUCBJNGTCR-UHFFFAOYSA-N
XLogP0.09
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 ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-2-(2-methylprop-2-enylamino)-1-morpholin-4-ylbutan-1-one
CID 84598838
(2S)-2-hydroxy-3-methyl-1-morpholin-4-ylbutan-1-one
CID 69460030
N-(3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl)benzamide
CID 78777337
2-amino-3-methyl-1-morpholin-4-ylbutan-1-one
CID 22492154
3-methyl-2-(methylamino)-1-(3-methylpiperidin-1-yl)butan-1-one
CID 59011431
(2S)-2-chloro-1-morpholin-4-ylpropan-1-one
CID 2434799
4-fluoro-N-[(2S)-3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl]benzamide
CID 9104538
(2R)-2-amino-1-(1,4,7-trioxa-10-azacyclododec-10-yl)propan-1-one
CID 1121708
(2R)-2-amino-1-morpholin-4-ylpropan-1-one;hydrochloride
CID 156637014
(2R)-2-(1H-imidazol-2-ylmethylamino)-3-methyl-1-morpholin-4-ylbutan-1-one
CID 97002473
N-methyl-4-[[(2S)-3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl]carbamoylamino]benzamide
CID 95975366
[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
CID 67759315

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one?
The IUPAC name of 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one (CID 110838021) is 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one.
What is the SMILES notation for 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one?
The canonical SMILES for 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one is CNC(C(=O)N1CCOCC1)C(C)C.
What is the InChIKey of 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one?
The InChIKey is OBIBDUCBJNGTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(2)9(11-3)10(13)12-4-6-14-7-5-12/h8-9,11H,4-7H2,1-3H3.
What are the key properties of 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one?
3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one has a molecular weight of 200.28 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(methylamino)-1-morpholin-4-ylbutan-1-one is sourced from PubChem (CID 110838021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).