[(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone

C11H20N2O2 — CID 142300145

IUPAC[(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone
SMILESCC1CCN(C)[C@@H]1C(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O2/c1-9-3-4-12(2)10(9)11(14)13-5-7-15-8-6-13/h9-10H,3-8H2,1-2H3/t9?,10-/m0/s1
InChIKeyXBJVNXAYSMEYNS-AXDSSHIGSA-N
MW212.29 g/mol
LogP0.19
Rot. Bonds1

About [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone

[(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone (PubChem CID 142300145) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone
PubChem CID142300145
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name[(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone
SMILESCC1CCN(C)[C@@H]1C(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O2/c1-9-3-4-12(2)10(9)11(14)13-5-7-15-8-6-13/h9-10H,3-8H2,1-2H3/t9?,10-/m0/s1
InChIKeyXBJVNXAYSMEYNS-AXDSSHIGSA-N
XLogP0.19
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methylpiperidin-1-yl)-[2-(morpholine-4-carbonyl)cyclopropyl]methanone
CID 109132556
3-methyl-1-(morpholine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 104937291
(2-methyloxolan-3-yl)-morpholin-4-ylmethanone
CID 79759463
1-(1,3-dimethylpyrrolidin-2-yl)-2,2-dimethylpropan-1-one
CID 59900109
[(1R,6R)-6-[(3S,4R)-3,4-dimethylpiperidine-1-carbonyl]cyclohex-3-en-1-yl]-morpholin-4-ylmethanone
CID 129430953
morpholin-4-yl(oxetan-2-yl)methanone
CID 130874953
(2-amino-3-methylcyclohexyl)-morpholin-4-ylmethanone
CID 62777723
1-[4-[4-(morpholine-4-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 109146746
(4-methylpiperidin-1-yl)-(oxan-4-yl)methanone
CID 78803278
(4-methylpyrrolidin-3-yl)-morpholin-4-ylmethanone
CID 63720609
[(3R)-1-methylpiperidin-3-yl]-morpholin-4-ylmethanone
CID 95907299
morpholin-4-yl-[(2R)-pyrrolidin-2-yl]methanone
CID 7175775

Frequently Asked Questions

What is the IUPAC name of [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone (CID 142300145) is [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone is CC1CCN(C)[C@@H]1C(=O)N1CCOCC1.
What is the InChIKey of [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone?
The InChIKey is XBJVNXAYSMEYNS-AXDSSHIGSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-9-3-4-12(2)10(9)11(14)13-5-7-15-8-6-13/h9-10H,3-8H2,1-2H3/t9?,10-/m0/s1.
What are the key properties of [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone?
[(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 212.29 g/mol, XLogP of 0.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1,3-dimethylpyrrolidin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 142300145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).