N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide

C12H12N2O2S — CID 110692203

IUPACN-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccns1
InChIInChI=1S/C12H12N2O2S/c1-2-16-10-6-4-3-5-9(10)14-12(15)11-7-8-13-17-11/h3-8H,2H2,1H3,(H,14,15)
InChIKeyPJWBHIPRNVYXDH-UHFFFAOYSA-N
MW248.31 g/mol
LogP2.79
Rot. Bonds4

About N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide

N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide (PubChem CID 110692203) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide
PubChem CID110692203
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC NameN-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccns1
InChIInChI=1S/C12H12N2O2S/c1-2-16-10-6-4-3-5-9(10)14-12(15)11-7-8-13-17-11/h3-8H,2H2,1H3,(H,14,15)
InChIKeyPJWBHIPRNVYXDH-UHFFFAOYSA-N
XLogP2.79
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide (CID 110692203) is N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide is CCOc1ccccc1NC(=O)c1ccns1.
What is the InChIKey of N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide?
The InChIKey is PJWBHIPRNVYXDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c1-2-16-10-6-4-3-5-9(10)14-12(15)11-7-8-13-17-11/h3-8H,2H2,1H3,(H,14,15).
What are the key properties of N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide?
N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide has a molecular weight of 248.31 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 110692203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).