CID 57424323

C3H6NO — CID 57424323

IUPAC—
SMILES[CH]1COCN1
InChIInChI=1S/C3H6NO/c1-2-5-3-4-1/h1,4H,2-3H2
InChIKeyQDVJGUVTVKEQCY-UHFFFAOYSA-N
MW72.09 g/mol
LogP-0.27
Rot. Bonds

About CID 57424323

CID 57424323 (PubChem CID 57424323) has the molecular formula C3H6NO and a molecular weight of 72.09 g/mol.

Molecular Properties

Compound NameCID 57424323
PubChem CID57424323
Molecular FormulaC3H6NO
Molecular Weight72.09 g/mol
Exact Mass72.04
IUPAC Name—
SMILES[CH]1COCN1
InChIInChI=1S/C3H6NO/c1-2-5-3-4-1/h1,4H,2-3H2
InChIKeyQDVJGUVTVKEQCY-UHFFFAOYSA-N
XLogP-0.27
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50072.09
LogP ≤ 5-0.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Oxazolidine
CID 536683
2-Oxazolidinethione
CID 2733223
2-Methyl-1,3-oxazolidine
CID 544812
2-Aminooxazolidine
CID 5249496
Thiooxazolidine
CID 21248213
2-Chloro-1,3-oxazolidine
CID 67400944
Oxazolidinylphosphine
CID 69863980
3-Oxazolidinium chloride
CID 70516418
Oxazolidinium bromide
CID 129786065
Oxazolidinium iodide
CID 129813257
2-Fluoro-1,3-oxazolidine
CID 21916574
5-Fluoro-1,3-oxazolidine
CID 153951546

Frequently Asked Questions

What is the IUPAC name of CID 57424323?
The IUPAC name of CID 57424323 (CID 57424323) is not available.
What is the SMILES notation for CID 57424323?
The canonical SMILES for CID 57424323 is [CH]1COCN1.
What is the InChIKey of CID 57424323?
The InChIKey is QDVJGUVTVKEQCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6NO/c1-2-5-3-4-1/h1,4H,2-3H2.
What are the key properties of CID 57424323?
CID 57424323 has a molecular weight of 72.09 g/mol, XLogP of -0.27, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57424323 is sourced from PubChem (CID 57424323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).