N-ethyl-1,3-thiazole-2-carboxamide

C6H8N2OS — CID 18006162

IUPACN-ethyl-1,3-thiazole-2-carboxamide
SMILESCCNC(=O)c1nccs1
InChIInChI=1S/C6H8N2OS/c1-2-7-5(9)6-8-3-4-10-6/h3-4H,2H2,1H3,(H,7,9)
InChIKeyBBHZJZKBZVPDFZ-UHFFFAOYSA-N
MW156.21 g/mol
LogP0.89
Rot. Bonds2

About N-ethyl-1,3-thiazole-2-carboxamide

N-ethyl-1,3-thiazole-2-carboxamide (PubChem CID 18006162) has the molecular formula C6H8N2OS and a molecular weight of 156.21 g/mol. Its IUPAC name is N-ethyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-1,3-thiazole-2-carboxamide
PubChem CID18006162
Molecular FormulaC6H8N2OS
Molecular Weight156.21 g/mol
Exact Mass156.04
IUPAC NameN-ethyl-1,3-thiazole-2-carboxamide
SMILESCCNC(=O)c1nccs1
InChIInChI=1S/C6H8N2OS/c1-2-7-5(9)6-8-3-4-10-6/h3-4H,2H2,1H3,(H,7,9)
InChIKeyBBHZJZKBZVPDFZ-UHFFFAOYSA-N
XLogP0.89
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1,3-thiazole-2-carboxamide?
The IUPAC name of N-ethyl-1,3-thiazole-2-carboxamide (CID 18006162) is N-ethyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N-ethyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for N-ethyl-1,3-thiazole-2-carboxamide is CCNC(=O)c1nccs1.
What is the InChIKey of N-ethyl-1,3-thiazole-2-carboxamide?
The InChIKey is BBHZJZKBZVPDFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2OS/c1-2-7-5(9)6-8-3-4-10-6/h3-4H,2H2,1H3,(H,7,9).
What are the key properties of N-ethyl-1,3-thiazole-2-carboxamide?
N-ethyl-1,3-thiazole-2-carboxamide has a molecular weight of 156.21 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 18006162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).