3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide

C6H7ClN2O2S — CID 130804739

IUPAC3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide
SMILESO=C(NCCO)c1cc(Cl)ns1
InChIInChI=1S/C6H7ClN2O2S/c7-5-3-4(12-9-5)6(11)8-1-2-10/h3,10H,1-2H2,(H,8,11)
InChIKeyADUFOALWVIORNG-UHFFFAOYSA-N
MW206.65 g/mol
LogP0.52
Rot. Bonds3

About 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide

3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide (PubChem CID 130804739) has the molecular formula C6H7ClN2O2S and a molecular weight of 206.65 g/mol. Its IUPAC name is 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide
PubChem CID130804739
Molecular FormulaC6H7ClN2O2S
Molecular Weight206.65 g/mol
Exact Mass205.99
IUPAC Name3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide
SMILESO=C(NCCO)c1cc(Cl)ns1
InChIInChI=1S/C6H7ClN2O2S/c7-5-3-4(12-9-5)6(11)8-1-2-10/h3,10H,1-2H2,(H,8,11)
InChIKeyADUFOALWVIORNG-UHFFFAOYSA-N
XLogP0.52
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.65
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-chloro-N-ethyl-1,2-thiazole-5-carboxamide
CID 127003282
N-butan-2-yl-3-chloro-1,2-thiazole-5-carboxamide
CID 130617010
3,6-dichloro-N-(2-hydroxyethyl)pyridazine-4-carboxamide
CID 43501013
3,6-dichloro-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 60692450
5-(3-chlorophenyl)-N-(2-hydroxyethyl)-1,2-oxazole-3-carboxamide
CID 78862555
N-(2-hydroxyethyl)thieno[3,2-b]thiophene-5-carboxamide
CID 30772849
5-chloro-N-(2-hydroxyethyl)-2-methylbenzamide
CID 115532800
2,6-dichloro-N-(4-hydroxybutyl)pyridine-4-carboxamide
CID 106841536
3-chloro-N-(2-hydroxyethyl)benzamide
CID 2181761
3-N,5-N-bis(2-hydroxyethyl)-1H-pyrazole-3,5-dicarboxamide
CID 163353826
N-(2-hydroxyethyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide
CID 43389911
3-(4-fluorophenyl)-N-propyl-1,2-thiazole-5-carboxamide
CID 53169211

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide?
The IUPAC name of 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide (CID 130804739) is 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide.
What is the SMILES notation for 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide?
The canonical SMILES for 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide is O=C(NCCO)c1cc(Cl)ns1.
What is the InChIKey of 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide?
The InChIKey is ADUFOALWVIORNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2O2S/c7-5-3-4(12-9-5)6(11)8-1-2-10/h3,10H,1-2H2,(H,8,11).
What are the key properties of 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide?
3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide has a molecular weight of 206.65 g/mol, XLogP of 0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-hydroxyethyl)-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 130804739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).