[2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone

C11H19NO4 — CID 81208221

IUPAC[2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone
SMILESCC1OCCC1C(=O)N1CCOC(CO)C1
InChIInChI=1S/C11H19NO4/c1-8-10(2-4-15-8)11(14)12-3-5-16-9(6-12)7-13/h8-10,13H,2-7H2,1H3
InChIKeyDLRZFBACISZPTE-UHFFFAOYSA-N
MW229.28 g/mol
LogP-0.37
Rot. Bonds2

About [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone

[2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone (PubChem CID 81208221) has the molecular formula C11H19NO4 and a molecular weight of 229.28 g/mol. Its IUPAC name is [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone.

Molecular Properties

Compound Name[2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone
PubChem CID81208221
Molecular FormulaC11H19NO4
Molecular Weight229.28 g/mol
Exact Mass229.13
IUPAC Name[2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone
SMILESCC1OCCC1C(=O)N1CCOC(CO)C1
InChIInChI=1S/C11H19NO4/c1-8-10(2-4-15-8)11(14)12-3-5-16-9(6-12)7-13/h8-10,13H,2-7H2,1H3
InChIKeyDLRZFBACISZPTE-UHFFFAOYSA-N
XLogP-0.37
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone?
The IUPAC name of [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone (CID 81208221) is [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone.
What is the SMILES notation for [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone?
The canonical SMILES for [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone is CC1OCCC1C(=O)N1CCOC(CO)C1.
What is the InChIKey of [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone?
The InChIKey is DLRZFBACISZPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO4/c1-8-10(2-4-15-8)11(14)12-3-5-16-9(6-12)7-13/h8-10,13H,2-7H2,1H3.
What are the key properties of [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone?
[2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone has a molecular weight of 229.28 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone is sourced from PubChem (CID 81208221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).