2-morpholin-4-ylpiperidine-1-carbaldehyde

C10H18N2O2 — CID 123830981

IUPAC2-morpholin-4-ylpiperidine-1-carbaldehyde
SMILESO=CN1CCCCC1N1CCOCC1
InChIInChI=1S/C10H18N2O2/c13-9-12-4-2-1-3-10(12)11-5-7-14-8-6-11/h9-10H,1-8H2
InChIKeyVFBMVLPPHLXKHD-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.29
Rot. Bonds2

About 2-morpholin-4-ylpiperidine-1-carbaldehyde

2-morpholin-4-ylpiperidine-1-carbaldehyde (PubChem CID 123830981) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-morpholin-4-ylpiperidine-1-carbaldehyde.

Molecular Properties

Compound Name2-morpholin-4-ylpiperidine-1-carbaldehyde
PubChem CID123830981
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name2-morpholin-4-ylpiperidine-1-carbaldehyde
SMILESO=CN1CCCCC1N1CCOCC1
InChIInChI=1S/C10H18N2O2/c13-9-12-4-2-1-3-10(12)11-5-7-14-8-6-11/h9-10H,1-8H2
InChIKeyVFBMVLPPHLXKHD-UHFFFAOYSA-N
XLogP0.29
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-morpholin-4-ylpiperazine-1-carbaldehyde
CID 91666126
1,4,7,10-tetraoxa-13-azacyclopentadecane-13-carbaldehyde
CID 86143378
ethane;4-morpholin-4-ylpiperidine-1-carbaldehyde
CID 142506557
(2S)-1-formylpiperidine-2-carboxylic acid
CID 65439701
2-(pyrrolidin-1-ylmethyl)piperidine-1-carbaldehyde
CID 88926703
3-cyclopropylmorpholine-4-carbaldehyde
CID 123226910
4-(1-cyclopentylpiperidin-4-yl)morpholine;oxalic acid
CID 17369368
4-(6-bicyclo[3.1.0]hexanyl)morpholine
CID 12811780
2-ethoxypiperidine-1-carbaldehyde
CID 87544079
2-(2-oxopropyl)azepane-1-carbaldehyde
CID 13117688
ethane;2-methylpyrrolidine-1-carbaldehyde
CID 177315996
4-(oxepan-4-yl)morpholine
CID 131201603

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylpiperidine-1-carbaldehyde?
The IUPAC name of 2-morpholin-4-ylpiperidine-1-carbaldehyde (CID 123830981) is 2-morpholin-4-ylpiperidine-1-carbaldehyde.
What is the SMILES notation for 2-morpholin-4-ylpiperidine-1-carbaldehyde?
The canonical SMILES for 2-morpholin-4-ylpiperidine-1-carbaldehyde is O=CN1CCCCC1N1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylpiperidine-1-carbaldehyde?
The InChIKey is VFBMVLPPHLXKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c13-9-12-4-2-1-3-10(12)11-5-7-14-8-6-11/h9-10H,1-8H2.
What are the key properties of 2-morpholin-4-ylpiperidine-1-carbaldehyde?
2-morpholin-4-ylpiperidine-1-carbaldehyde has a molecular weight of 198.27 g/mol, XLogP of 0.29, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylpiperidine-1-carbaldehyde is sourced from PubChem (CID 123830981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).