2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde

C6H10N2O2 — CID 57135184

IUPAC2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde
SMILESCN1CCN(CC=O)C1=O
InChIInChI=1S/C6H10N2O2/c1-7-2-3-8(4-5-9)6(7)10/h5H,2-4H2,1H3
InChIKeyMQWWXJBTMFEDIA-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.45
Rot. Bonds2

About 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde

2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde (PubChem CID 57135184) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde.

Molecular Properties

Compound Name2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde
PubChem CID57135184
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde
SMILESCN1CCN(CC=O)C1=O
InChIInChI=1S/C6H10N2O2/c1-7-2-3-8(4-5-9)6(7)10/h5H,2-4H2,1H3
InChIKeyMQWWXJBTMFEDIA-UHFFFAOYSA-N
XLogP-0.45
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde?
The IUPAC name of 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde (CID 57135184) is 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde.
What is the SMILES notation for 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde?
The canonical SMILES for 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde is CN1CCN(CC=O)C1=O.
What is the InChIKey of 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde?
The InChIKey is MQWWXJBTMFEDIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-7-2-3-8(4-5-9)6(7)10/h5H,2-4H2,1H3.
What are the key properties of 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde?
2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde has a molecular weight of 142.16 g/mol, XLogP of -0.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde is sourced from PubChem (CID 57135184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).