5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride

C5H11ClN2O2 — CID 71758299

IUPAC5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride
SMILESCN1CC(CN)OC1=O.Cl
InChIInChI=1S/C5H10N2O2.ClH/c1-7-3-4(2-6)9-5(7)8;/h4H,2-3,6H2,1H3;1H
InChIKeyRNPAVMPXAQDZJY-UHFFFAOYSA-N
MW166.61 g/mol
LogP-0.18
Rot. Bonds1

About 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride

5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride (PubChem CID 71758299) has the molecular formula C5H11ClN2O2 and a molecular weight of 166.61 g/mol. Its IUPAC name is 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride.

Molecular Properties

Compound Name5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride
PubChem CID71758299
Molecular FormulaC5H11ClN2O2
Molecular Weight166.61 g/mol
Exact Mass166.05
IUPAC Name5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride
SMILESCN1CC(CN)OC1=O.Cl
InChIInChI=1S/C5H10N2O2.ClH/c1-7-3-4(2-6)9-5(7)8;/h4H,2-3,6H2,1H3;1H
InChIKeyRNPAVMPXAQDZJY-UHFFFAOYSA-N
XLogP-0.18
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.61
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride?
The IUPAC name of 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride (CID 71758299) is 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride.
What is the SMILES notation for 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride?
The canonical SMILES for 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride is CN1CC(CN)OC1=O.Cl.
What is the InChIKey of 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride?
The InChIKey is RNPAVMPXAQDZJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2.ClH/c1-7-3-4(2-6)9-5(7)8;/h4H,2-3,6H2,1H3;1H.
What are the key properties of 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride?
5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride has a molecular weight of 166.61 g/mol, XLogP of -0.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-3-methyl-1,3-oxazolidin-2-one;hydrochloride is sourced from PubChem (CID 71758299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).