1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone

C11H20N2O3 — CID 81203465

IUPAC1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone
SMILESO=C(CC1CCNC1)N1CCOC(CO)C1
InChIInChI=1S/C11H20N2O3/c14-8-10-7-13(3-4-16-10)11(15)5-9-1-2-12-6-9/h9-10,12,14H,1-8H2
InChIKeyFMTLTPSSBBEGFA-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.79
Rot. Bonds3

About 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone

1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone (PubChem CID 81203465) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone.

Molecular Properties

Compound Name1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone
PubChem CID81203465
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone
SMILESO=C(CC1CCNC1)N1CCOC(CO)C1
InChIInChI=1S/C11H20N2O3/c14-8-10-7-13(3-4-16-10)11(15)5-9-1-2-12-6-9/h9-10,12,14H,1-8H2
InChIKeyFMTLTPSSBBEGFA-UHFFFAOYSA-N
XLogP-0.79
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-piperidin-4-ylacetyl)morpholine-2-carbonitrile
CID 79674503
1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone
CID 81202847
2-bromo-1-[2-(hydroxymethyl)morpholin-4-yl]ethanone
CID 81203713
1-(2-ethylmorpholin-4-yl)-2-morpholin-2-ylethanone
CID 66432993
1-[2-(chloromethyl)morpholin-4-yl]-2-cyclohexylethanone
CID 81210447
cyclopropyl-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81208707
1-[2-(hydroxymethyl)morpholin-4-yl]-2-methoxyethanone
CID 81208943
1-[2-(aminomethyl)morpholin-4-yl]-2-cyclobutylethanone
CID 104922136
1-[3-(hydroxymethyl)azetidin-1-yl]-2-piperidin-4-ylethanone
CID 107220425
1-(3-methoxypyrrolidin-1-yl)-2-pyrrolidin-3-ylethanone
CID 103533035
1-(2-phenylmorpholin-4-yl)-2-piperidin-3-ylethanone
CID 62676153
1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-morpholin-2-ylethanone
CID 107217362

Frequently Asked Questions

What is the IUPAC name of 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone?
The IUPAC name of 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone (CID 81203465) is 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone.
What is the SMILES notation for 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone?
The canonical SMILES for 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone is O=C(CC1CCNC1)N1CCOC(CO)C1.
What is the InChIKey of 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone?
The InChIKey is FMTLTPSSBBEGFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c14-8-10-7-13(3-4-16-10)11(15)5-9-1-2-12-6-9/h9-10,12,14H,1-8H2.
What are the key properties of 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone?
1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone has a molecular weight of 228.29 g/mol, XLogP of -0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone is sourced from PubChem (CID 81203465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).