N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide

C19H18N2O2S — CID 110650287

IUPACN-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide
SMILESCCOc1ccccc1NC(=O)c1nc(-c2ccccc2)sc1C
InChIInChI=1S/C19H18N2O2S/c1-3-23-16-12-8-7-11-15(16)20-18(22)17-13(2)24-19(21-17)14-9-5-4-6-10-14/h4-12H,3H2,1-2H3,(H,20,22)
InChIKeyYWUXLODCSDTFSD-UHFFFAOYSA-N
MW338.43 g/mol
LogP4.77
Rot. Bonds5

About N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide

N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide (PubChem CID 110650287) has the molecular formula C19H18N2O2S and a molecular weight of 338.43 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide
PubChem CID110650287
Molecular FormulaC19H18N2O2S
Molecular Weight338.43 g/mol
Exact Mass338.11
IUPAC NameN-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide
SMILESCCOc1ccccc1NC(=O)c1nc(-c2ccccc2)sc1C
InChIInChI=1S/C19H18N2O2S/c1-3-23-16-12-8-7-11-15(16)20-18(22)17-13(2)24-19(21-17)14-9-5-4-6-10-14/h4-12H,3H2,1-2H3,(H,20,22)
InChIKeyYWUXLODCSDTFSD-UHFFFAOYSA-N
XLogP4.77
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide (CID 110650287) is N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide is CCOc1ccccc1NC(=O)c1nc(-c2ccccc2)sc1C.
What is the InChIKey of N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide?
The InChIKey is YWUXLODCSDTFSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2S/c1-3-23-16-12-8-7-11-15(16)20-18(22)17-13(2)24-19(21-17)14-9-5-4-6-10-14/h4-12H,3H2,1-2H3,(H,20,22).
What are the key properties of N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide?
N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide has a molecular weight of 338.43 g/mol, XLogP of 4.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 110650287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).