3-cyclopropylmorpholine-4-carbaldehyde

C8H13NO2 — CID 123226910

IUPAC3-cyclopropylmorpholine-4-carbaldehyde
SMILESO=CN1CCOCC1C1CC1
InChIInChI=1S/C8H13NO2/c10-6-9-3-4-11-5-8(9)7-1-2-7/h6-8H,1-5H2
InChIKeyYZRSFTLMFPUFIY-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.25
Rot. Bonds2

About 3-cyclopropylmorpholine-4-carbaldehyde

3-cyclopropylmorpholine-4-carbaldehyde (PubChem CID 123226910) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 3-cyclopropylmorpholine-4-carbaldehyde.

Molecular Properties

Compound Name3-cyclopropylmorpholine-4-carbaldehyde
PubChem CID123226910
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name3-cyclopropylmorpholine-4-carbaldehyde
SMILESO=CN1CCOCC1C1CC1
InChIInChI=1S/C8H13NO2/c10-6-9-3-4-11-5-8(9)7-1-2-7/h6-8H,1-5H2
InChIKeyYZRSFTLMFPUFIY-UHFFFAOYSA-N
XLogP0.25
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrole-4-carbaldehyde
CID 143609286
3-(hydroxymethyl)morpholine-4-carbaldehyde
CID 87595725
2-cyclopropylpiperazine-1-carbaldehyde
CID 87187769
3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbaldehyde
CID 64992279
3-ethoxymorpholine-4-carbaldehyde
CID 174369986
ethane;1-methylazetidine;3-methylmorpholine-4-carbaldehyde
CID 168940768
3-(methoxymethyl)morpholine-4-carbaldehyde
CID 112537810
2-chloro-1-(3-cyclopropylmorpholin-4-yl)ethanone
CID 71757652
4-(oxan-4-yl)piperidine-1-carbaldehyde
CID 143294337
3-(5-pyridin-3-yl-4,5-dihydro-1,3-oxazol-4-yl)morpholine-4-carbaldehyde
CID 87854794
4-(2-bromoprop-2-enyl)-3-cyclopropylmorpholine
CID 130660267
1,4,7,10-tetraoxa-13-azacyclopentadecane-13-carbaldehyde
CID 86143378

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropylmorpholine-4-carbaldehyde?
The IUPAC name of 3-cyclopropylmorpholine-4-carbaldehyde (CID 123226910) is 3-cyclopropylmorpholine-4-carbaldehyde.
What is the SMILES notation for 3-cyclopropylmorpholine-4-carbaldehyde?
The canonical SMILES for 3-cyclopropylmorpholine-4-carbaldehyde is O=CN1CCOCC1C1CC1.
What is the InChIKey of 3-cyclopropylmorpholine-4-carbaldehyde?
The InChIKey is YZRSFTLMFPUFIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c10-6-9-3-4-11-5-8(9)7-1-2-7/h6-8H,1-5H2.
What are the key properties of 3-cyclopropylmorpholine-4-carbaldehyde?
3-cyclopropylmorpholine-4-carbaldehyde has a molecular weight of 155.20 g/mol, XLogP of 0.25, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropylmorpholine-4-carbaldehyde is sourced from PubChem (CID 123226910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).