2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone

C11H20N2O3 — CID 114468321

IUPAC2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone
SMILESO=C(COCC1CNCCO1)N1CCCC1
InChIInChI=1S/C11H20N2O3/c14-11(13-4-1-2-5-13)9-15-8-10-7-12-3-6-16-10/h10,12H,1-9H2
InChIKeyTWKLKPRGRBYUQB-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.39
Rot. Bonds4

About 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone

2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone (PubChem CID 114468321) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone.

Molecular Properties

Compound Name2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone
PubChem CID114468321
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone
SMILESO=C(COCC1CNCCO1)N1CCCC1
InChIInChI=1S/C11H20N2O3/c14-11(13-4-1-2-5-13)9-15-8-10-7-12-3-6-16-10/h10,12H,1-9H2
InChIKeyTWKLKPRGRBYUQB-UHFFFAOYSA-N
XLogP-0.39
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone?
The IUPAC name of 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone (CID 114468321) is 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone.
What is the SMILES notation for 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone?
The canonical SMILES for 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone is O=C(COCC1CNCCO1)N1CCCC1.
What is the InChIKey of 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone?
The InChIKey is TWKLKPRGRBYUQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c14-11(13-4-1-2-5-13)9-15-8-10-7-12-3-6-16-10/h10,12H,1-9H2.
What are the key properties of 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone?
2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone has a molecular weight of 228.29 g/mol, XLogP of -0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone is sourced from PubChem (CID 114468321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).