2-(2-hydroxymorpholin-4-yl)acetaldehyde

C6H11NO3 — CID 90238085

IUPAC2-(2-hydroxymorpholin-4-yl)acetaldehyde
SMILESO=CCN1CCOC(O)C1
InChIInChI=1S/C6H11NO3/c8-3-1-7-2-4-10-6(9)5-7/h3,6,9H,1-2,4-5H2
InChIKeyLQDTZXKAVKMWGL-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.16
Rot. Bonds2

About 2-(2-hydroxymorpholin-4-yl)acetaldehyde

2-(2-hydroxymorpholin-4-yl)acetaldehyde (PubChem CID 90238085) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 2-(2-hydroxymorpholin-4-yl)acetaldehyde.

Molecular Properties

Compound Name2-(2-hydroxymorpholin-4-yl)acetaldehyde
PubChem CID90238085
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name2-(2-hydroxymorpholin-4-yl)acetaldehyde
SMILESO=CCN1CCOC(O)C1
InChIInChI=1S/C6H11NO3/c8-3-1-7-2-4-10-6(9)5-7/h3,6,9H,1-2,4-5H2
InChIKeyLQDTZXKAVKMWGL-UHFFFAOYSA-N
XLogP-1.16
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

(2R)-4-(2-pyrrolidin-1-ylethyl)morpholin-2-ol
CID 163851059
4-propylmorpholin-2-ol
CID 126640355
2-[(3R)-3-hydroxypyrrolidin-1-yl]acetaldehyde
CID 90692786
4-(2-amino-2-hydroxyethyl)morpholin-2-ol
CID 161008921
2-(4-prop-2-enylmorpholin-2-yl)acetaldehyde
CID 173469900
2-[4,7-bis(2-oxoethyl)-1,4,7-triazonan-1-yl]acetaldehyde
CID 20775518
2-(3-fluoropyrrolidin-1-yl)acetaldehyde;hydrochloride
CID 115013371
2-(bromomethyl)-4-(3-methylbut-2-enyl)morpholine
CID 107901151
4-methylmorpholin-2-ol;hydrate
CID 175404438
2-(2-hydroxymorpholin-4-yl)benzaldehyde
CID 174458746
2-[2-(2-chloropyrrolo[2,3-d]pyrimidin-7-yl)morpholin-4-yl]acetaldehyde
CID 90237943
2-[3-(methoxymethyl)pyrrolidin-1-yl]acetaldehyde
CID 64598603

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxymorpholin-4-yl)acetaldehyde?
The IUPAC name of 2-(2-hydroxymorpholin-4-yl)acetaldehyde (CID 90238085) is 2-(2-hydroxymorpholin-4-yl)acetaldehyde.
What is the SMILES notation for 2-(2-hydroxymorpholin-4-yl)acetaldehyde?
The canonical SMILES for 2-(2-hydroxymorpholin-4-yl)acetaldehyde is O=CCN1CCOC(O)C1.
What is the InChIKey of 2-(2-hydroxymorpholin-4-yl)acetaldehyde?
The InChIKey is LQDTZXKAVKMWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c8-3-1-7-2-4-10-6(9)5-7/h3,6,9H,1-2,4-5H2.
What are the key properties of 2-(2-hydroxymorpholin-4-yl)acetaldehyde?
2-(2-hydroxymorpholin-4-yl)acetaldehyde has a molecular weight of 145.16 g/mol, XLogP of -1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxymorpholin-4-yl)acetaldehyde is sourced from PubChem (CID 90238085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).