1,3-oxazolidine;hydrochloride

C3H8ClNO — CID 21317004

IUPAC1,3-oxazolidine;hydrochloride
SMILESC1COCN1.Cl
InChIInChI=1S/C3H7NO.ClH/c1-2-5-3-4-1;/h4H,1-3H2;1H
InChIKeyVYGXSMYEELSIAI-UHFFFAOYSA-N
MW109.56 g/mol
LogP-0.01
Rot. Bonds

About 1,3-oxazolidine;hydrochloride

1,3-oxazolidine;hydrochloride (PubChem CID 21317004) has the molecular formula C3H8ClNO and a molecular weight of 109.56 g/mol. Its IUPAC name is 1,3-oxazolidine;hydrochloride.

Molecular Properties

Compound Name1,3-oxazolidine;hydrochloride
PubChem CID21317004
Molecular FormulaC3H8ClNO
Molecular Weight109.56 g/mol
Exact Mass109.03
IUPAC Name1,3-oxazolidine;hydrochloride
SMILESC1COCN1.Cl
InChIInChI=1S/C3H7NO.ClH/c1-2-5-3-4-1;/h4H,1-3H2;1H
InChIKeyVYGXSMYEELSIAI-UHFFFAOYSA-N
XLogP-0.01
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.56
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Oxazolidine
CID 536683
2-Methyl-1,3-oxazolidine
CID 544812
2-Aminooxazolidine
CID 5249496
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
Oxazolidin-2-ylidene palladium
CID 129663046
2-Lithiooxazolidine
CID 129675664

Frequently Asked Questions

What is the IUPAC name of 1,3-oxazolidine;hydrochloride?
The IUPAC name of 1,3-oxazolidine;hydrochloride (CID 21317004) is 1,3-oxazolidine;hydrochloride.
What is the SMILES notation for 1,3-oxazolidine;hydrochloride?
The canonical SMILES for 1,3-oxazolidine;hydrochloride is C1COCN1.Cl.
What is the InChIKey of 1,3-oxazolidine;hydrochloride?
The InChIKey is VYGXSMYEELSIAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.ClH/c1-2-5-3-4-1;/h4H,1-3H2;1H.
What are the key properties of 1,3-oxazolidine;hydrochloride?
1,3-oxazolidine;hydrochloride has a molecular weight of 109.56 g/mol, XLogP of -0.01, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-oxazolidine;hydrochloride is sourced from PubChem (CID 21317004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).