2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde

C10H19N3O2 — CID 57290864

IUPAC2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde
SMILESO=CC(N1CCNCC1)N1CCOCC1
InChIInChI=1S/C10H19N3O2/c14-9-10(12-3-1-11-2-4-12)13-5-7-15-8-6-13/h9-11H,1-8H2
InChIKeyCWOOIVNVNHYXOS-UHFFFAOYSA-N
MW213.28 g/mol
LogP-1.25
Rot. Bonds3

About 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde

2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde (PubChem CID 57290864) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde.

Molecular Properties

Compound Name2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde
PubChem CID57290864
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde
SMILESO=CC(N1CCNCC1)N1CCOCC1
InChIInChI=1S/C10H19N3O2/c14-9-10(12-3-1-11-2-4-12)13-5-7-15-8-6-13/h9-11H,1-8H2
InChIKeyCWOOIVNVNHYXOS-UHFFFAOYSA-N
XLogP-1.25
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-1.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde?
The IUPAC name of 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde (CID 57290864) is 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde.
What is the SMILES notation for 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde?
The canonical SMILES for 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde is O=CC(N1CCNCC1)N1CCOCC1.
What is the InChIKey of 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde?
The InChIKey is CWOOIVNVNHYXOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c14-9-10(12-3-1-11-2-4-12)13-5-7-15-8-6-13/h9-11H,1-8H2.
What are the key properties of 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde?
2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde has a molecular weight of 213.28 g/mol, XLogP of -1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-2-piperazin-1-ylacetaldehyde is sourced from PubChem (CID 57290864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).