2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

C17H14N2O2S — CID 2072952

IUPAC2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C17H14N2O2S/c1-21-15-10-6-5-9-13(15)16(20)19-17-18-14(11-22-17)12-7-3-2-4-8-12/h2-11H,1H3,(H,18,19,20)
InChIKeyOGPMPAUGGNRKAU-UHFFFAOYSA-N
MW310.38 g/mol
LogP4.07
Rot. Bonds4

About 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (PubChem CID 2072952) has the molecular formula C17H14N2O2S and a molecular weight of 310.38 g/mol. Its IUPAC name is 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
PubChem CID2072952
Molecular FormulaC17H14N2O2S
Molecular Weight310.38 g/mol
Exact Mass310.08
IUPAC Name2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C17H14N2O2S/c1-21-15-10-6-5-9-13(15)16(20)19-17-18-14(11-22-17)12-7-3-2-4-8-12/h2-11H,1H3,(H,18,19,20)
InChIKeyOGPMPAUGGNRKAU-UHFFFAOYSA-N
XLogP4.07
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (CID 2072952) is 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is COc1ccccc1C(=O)Nc1nc(-c2ccccc2)cs1.
What is the InChIKey of 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is OGPMPAUGGNRKAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2S/c1-21-15-10-6-5-9-13(15)16(20)19-17-18-14(11-22-17)12-7-3-2-4-8-12/h2-11H,1H3,(H,18,19,20).
What are the key properties of 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 310.38 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 2072952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).