2-chloro-N-ethyl-1,3-thiazole-5-carboxamide

C6H7ClN2OS — CID 170344916

IUPAC2-chloro-N-ethyl-1,3-thiazole-5-carboxamide
SMILESCCNC(=O)c1cnc(Cl)s1
InChIInChI=1S/C6H7ClN2OS/c1-2-8-5(10)4-3-9-6(7)11-4/h3H,2H2,1H3,(H,8,10)
InChIKeySNMBCEZEHUQCHG-UHFFFAOYSA-N
MW190.66 g/mol
LogP1.55
Rot. Bonds2

About 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide

2-chloro-N-ethyl-1,3-thiazole-5-carboxamide (PubChem CID 170344916) has the molecular formula C6H7ClN2OS and a molecular weight of 190.66 g/mol. Its IUPAC name is 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-1,3-thiazole-5-carboxamide
PubChem CID170344916
Molecular FormulaC6H7ClN2OS
Molecular Weight190.66 g/mol
Exact Mass190.00
IUPAC Name2-chloro-N-ethyl-1,3-thiazole-5-carboxamide
SMILESCCNC(=O)c1cnc(Cl)s1
InChIInChI=1S/C6H7ClN2OS/c1-2-8-5(10)4-3-9-6(7)11-4/h3H,2H2,1H3,(H,8,10)
InChIKeySNMBCEZEHUQCHG-UHFFFAOYSA-N
XLogP1.55
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.66
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-ethyl-1,2-thiazole-5-carboxamide
CID 127003282
N-[(4-chlorophenyl)methyl]-2-ethyl-1,3-thiazole-5-carboxamide
CID 48571043
6-chloro-N-ethylpyridine-3-carboxamide
CID 819370
chlorobenzene;ethyl 2-chloro-1,3-thiazole-5-carboxylate
CID 20535196
2-ethyl-N-(2-hydroxypropyl)-1,3-thiazole-5-carboxamide
CID 110907781
5-bromo-3-chloro-N-ethylpyridine-2-carboxamide
CID 155923575
2-chloro-5-propyl-1,3-thiazole
CID 56625607
CID 59369604
CID 59369604
N-ethyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 121479827
1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-ethyl-2-nitroguanidine
CID 173316069
2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide
CID 82171902
N-[2-(4-chlorophenoxy)ethyl]-2-propyl-1,3-thiazole-5-carboxamide
CID 57210461

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide (CID 170344916) is 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide is CCNC(=O)c1cnc(Cl)s1.
What is the InChIKey of 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide?
The InChIKey is SNMBCEZEHUQCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2OS/c1-2-8-5(10)4-3-9-6(7)11-4/h3H,2H2,1H3,(H,8,10).
What are the key properties of 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide?
2-chloro-N-ethyl-1,3-thiazole-5-carboxamide has a molecular weight of 190.66 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 170344916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).