(5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide

C15H16FN3O4 — CID 58599566

IUPAC(5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide
SMILESCNC(=O)[C@H]1CN(c2ccc3c(c2)CC(=O)N3CCF)C(=O)O1
InChIInChI=1S/C15H16FN3O4/c1-17-14(21)12-8-19(15(22)23-12)10-2-3-11-9(6-10)7-13(20)18(11)5-4-16/h2-3,6,12H,4-5,7-8H2,1H3,(H,17,21)/t12-/m1/s1
InChIKeyOLQKWBGUKUFPRO-GFCCVEGCSA-N
MW321.31 g/mol
LogP0.62
Rot. Bonds4

About (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide

(5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide (PubChem CID 58599566) has the molecular formula C15H16FN3O4 and a molecular weight of 321.31 g/mol. Its IUPAC name is (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide.

Molecular Properties

Compound Name(5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide
PubChem CID58599566
Molecular FormulaC15H16FN3O4
Molecular Weight321.31 g/mol
Exact Mass321.11
IUPAC Name(5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide
SMILESCNC(=O)[C@H]1CN(c2ccc3c(c2)CC(=O)N3CCF)C(=O)O1
InChIInChI=1S/C15H16FN3O4/c1-17-14(21)12-8-19(15(22)23-12)10-2-3-11-9(6-10)7-13(20)18(11)5-4-16/h2-3,6,12H,4-5,7-8H2,1H3,(H,17,21)/t12-/m1/s1
InChIKeyOLQKWBGUKUFPRO-GFCCVEGCSA-N
XLogP0.62
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.31
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide?
The IUPAC name of (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide (CID 58599566) is (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide.
What is the SMILES notation for (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide?
The canonical SMILES for (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide is CNC(=O)[C@H]1CN(c2ccc3c(c2)CC(=O)N3CCF)C(=O)O1.
What is the InChIKey of (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide?
The InChIKey is OLQKWBGUKUFPRO-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H16FN3O4/c1-17-14(21)12-8-19(15(22)23-12)10-2-3-11-9(6-10)7-13(20)18(11)5-4-16/h2-3,6,12H,4-5,7-8H2,1H3,(H,17,21)/t12-/m1/s1.
What are the key properties of (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide?
(5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide has a molecular weight of 321.31 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-[1-(2-fluoroethyl)-2-oxo-3H-indol-5-yl]-N-methyl-2-oxo-1,3-oxazolidine-5-carboxamide is sourced from PubChem (CID 58599566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).