N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide

C15H15N3O3S — CID 86836373

IUPACN-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide
SMILESCc1ncc(CNC(=O)c2cccc(N3CCOC3=O)c2)s1
InChIInChI=1S/C15H15N3O3S/c1-10-16-8-13(22-10)9-17-14(19)11-3-2-4-12(7-11)18-5-6-21-15(18)20/h2-4,7-8H,5-6,9H2,1H3,(H,17,19)
InChIKeyDFOXDNJKMBGGIK-UHFFFAOYSA-N
MW317.37 g/mol
LogP2.34
Rot. Bonds4

About N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide

N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide (PubChem CID 86836373) has the molecular formula C15H15N3O3S and a molecular weight of 317.37 g/mol. Its IUPAC name is N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide.

Molecular Properties

Compound NameN-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide
PubChem CID86836373
Molecular FormulaC15H15N3O3S
Molecular Weight317.37 g/mol
Exact Mass317.08
IUPAC NameN-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide
SMILESCc1ncc(CNC(=O)c2cccc(N3CCOC3=O)c2)s1
InChIInChI=1S/C15H15N3O3S/c1-10-16-8-13(22-10)9-17-14(19)11-3-2-4-12(7-11)18-5-6-21-15(18)20/h2-4,7-8H,5-6,9H2,1H3,(H,17,19)
InChIKeyDFOXDNJKMBGGIK-UHFFFAOYSA-N
XLogP2.34
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide?
The IUPAC name of N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide (CID 86836373) is N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide.
What is the SMILES notation for N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide?
The canonical SMILES for N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide is Cc1ncc(CNC(=O)c2cccc(N3CCOC3=O)c2)s1.
What is the InChIKey of N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide?
The InChIKey is DFOXDNJKMBGGIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3S/c1-10-16-8-13(22-10)9-17-14(19)11-3-2-4-12(7-11)18-5-6-21-15(18)20/h2-4,7-8H,5-6,9H2,1H3,(H,17,19).
What are the key properties of N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide?
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide has a molecular weight of 317.37 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide is sourced from PubChem (CID 86836373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).