2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide

C18H15N3O2S — CID 1230956

IUPAC2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1C(=O)Nc1nccs1
InChIInChI=1S/C18H15N3O2S/c22-16(12-13-6-2-1-3-7-13)20-15-9-5-4-8-14(15)17(23)21-18-19-10-11-24-18/h1-11H,12H2,(H,20,22)(H,19,21,23)
InChIKeyZGXGKYPLFKJVSY-UHFFFAOYSA-N
MW337.40 g/mol
LogP3.58
Rot. Bonds5

About 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide

2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 1230956) has the molecular formula C18H15N3O2S and a molecular weight of 337.40 g/mol. Its IUPAC name is 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide
PubChem CID1230956
Molecular FormulaC18H15N3O2S
Molecular Weight337.40 g/mol
Exact Mass337.09
IUPAC Name2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1C(=O)Nc1nccs1
InChIInChI=1S/C18H15N3O2S/c22-16(12-13-6-2-1-3-7-13)20-15-9-5-4-8-14(15)17(23)21-18-19-10-11-24-18/h1-11H,12H2,(H,20,22)(H,19,21,23)
InChIKeyZGXGKYPLFKJVSY-UHFFFAOYSA-N
XLogP3.58
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide (CID 1230956) is 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide is O=C(Cc1ccccc1)Nc1ccccc1C(=O)Nc1nccs1.
What is the InChIKey of 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is ZGXGKYPLFKJVSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2S/c22-16(12-13-6-2-1-3-7-13)20-15-9-5-4-8-14(15)17(23)21-18-19-10-11-24-18/h1-11H,12H2,(H,20,22)(H,19,21,23).
What are the key properties of 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide?
2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 337.40 g/mol, XLogP of 3.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenylacetyl)amino]-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 1230956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).