1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone

C11H20N2O2 — CID 95156154

IUPAC1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone
SMILESC[C@H]1CN(C(=O)CN2CCCC2)CCO1
InChIInChI=1S/C11H20N2O2/c1-10-8-13(6-7-15-10)11(14)9-12-4-2-3-5-12/h10H,2-9H2,1H3/t10-/m0/s1
InChIKeyKEJQULWSAXUSQQ-JTQLQIEISA-N
MW212.29 g/mol
LogP0.33
Rot. Bonds2

About 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone

1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone (PubChem CID 95156154) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone.

Molecular Properties

Compound Name1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone
PubChem CID95156154
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone
SMILESC[C@H]1CN(C(=O)CN2CCCC2)CCO1
InChIInChI=1S/C11H20N2O2/c1-10-8-13(6-7-15-10)11(14)9-12-4-2-3-5-12/h10H,2-9H2,1H3/t10-/m0/s1
InChIKeyKEJQULWSAXUSQQ-JTQLQIEISA-N
XLogP0.33
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Morpholine, 4-((2-oxo-1-pyrrolidinyl)acetyl)-
CID 746914
2-(2-ethylmorpholin-4-yl)-N-(2-methoxyethyl)acetamide
CID 53525516
2-(2-ethylmorpholin-4-yl)-N-propylacetamide
CID 53525517
2-[4-(2-Ethoxyethyl)-3-ethylpiperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 53596202
2-[4-(2-Ethoxyethyl)-3-methylpiperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 53610261
2-[3-Ethyl-4-(2-methoxyethyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 53610274
1-{2-[4-(2-Methoxyethyl)-1-piperazinyl]-2-oxoethyl}-2-pyrrolidinone
CID 1822554
1-[2-[4-(2-Ethoxyethyl)piperazin-1-yl]-2-oxoethyl]pyrrolidin-2-one
CID 1822705
2-[4-(2-Ethoxyethyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 53529972
1-[4-(2-Ethoxyethyl)piperazin-1-yl]-2-pyrrolidin-1-ylethanone
CID 53579809
1-[3-[4-(2-Ethoxyethyl)piperazin-1-yl]propyl]pyrrolidin-2-one
CID 53595143
1-(2,6-Dimethylmorpholin-4-yl)-2-[propyl(2,2,2-trifluoroethyl)amino]ethanone
CID 72017177

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone?
The IUPAC name of 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone (CID 95156154) is 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone.
What is the SMILES notation for 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone?
The canonical SMILES for 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone is C[C@H]1CN(C(=O)CN2CCCC2)CCO1.
What is the InChIKey of 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone?
The InChIKey is KEJQULWSAXUSQQ-JTQLQIEISA-N. The full InChI is InChI=1S/C11H20N2O2/c1-10-8-13(6-7-15-10)11(14)9-12-4-2-3-5-12/h10H,2-9H2,1H3/t10-/m0/s1.
What are the key properties of 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone?
1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone has a molecular weight of 212.29 g/mol, XLogP of 0.33, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-methylmorpholin-4-yl]-2-pyrrolidin-1-ylethanone is sourced from PubChem (CID 95156154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).