(5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one

C13H15N3O3 — CID 69319575

IUPAC(5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one
SMILESCN1C(=O)C(N2C[C@@H](CN)OC2=O)c2ccccc21
InChIInChI=1S/C13H15N3O3/c1-15-10-5-3-2-4-9(10)11(12(15)17)16-7-8(6-14)19-13(16)18/h2-5,8,11H,6-7,14H2,1H3/t8-,11?/m1/s1
InChIKeyDSXGMSBRADBEIL-RZZZFEHKSA-N
MW261.28 g/mol
LogP0.48
Rot. Bonds2

About (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one

(5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one (PubChem CID 69319575) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one
PubChem CID69319575
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC Name(5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one
SMILESCN1C(=O)C(N2C[C@@H](CN)OC2=O)c2ccccc21
InChIInChI=1S/C13H15N3O3/c1-15-10-5-3-2-4-9(10)11(12(15)17)16-7-8(6-14)19-13(16)18/h2-5,8,11H,6-7,14H2,1H3/t8-,11?/m1/s1
InChIKeyDSXGMSBRADBEIL-RZZZFEHKSA-N
XLogP0.48
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one (CID 69319575) is (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one is CN1C(=O)C(N2C[C@@H](CN)OC2=O)c2ccccc21.
What is the InChIKey of (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one?
The InChIKey is DSXGMSBRADBEIL-RZZZFEHKSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-15-10-5-3-2-4-9(10)11(12(15)17)16-7-8(6-14)19-13(16)18/h2-5,8,11H,6-7,14H2,1H3/t8-,11?/m1/s1.
What are the key properties of (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one?
(5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one has a molecular weight of 261.28 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(aminomethyl)-3-(1-methyl-2-oxo-3H-indol-3-yl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 69319575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).