N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide

C12H15ClN2O2S — CID 110792775

IUPACN-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide
SMILESCOc1cc(C)c(Cl)cc1NC(=O)C1CSCN1
InChIInChI=1S/C12H15ClN2O2S/c1-7-3-11(17-2)9(4-8(7)13)15-12(16)10-5-18-6-14-10/h3-4,10,14H,5-6H2,1-2H3,(H,15,16)
InChIKeyRHCPEBWQBOPOMO-UHFFFAOYSA-N
MW286.78 g/mol
LogP2.26
Rot. Bonds3

About N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide

N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 110792775) has the molecular formula C12H15ClN2O2S and a molecular weight of 286.78 g/mol. Its IUPAC name is N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide
PubChem CID110792775
Molecular FormulaC12H15ClN2O2S
Molecular Weight286.78 g/mol
Exact Mass286.05
IUPAC NameN-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide
SMILESCOc1cc(C)c(Cl)cc1NC(=O)C1CSCN1
InChIInChI=1S/C12H15ClN2O2S/c1-7-3-11(17-2)9(4-8(7)13)15-12(16)10-5-18-6-14-10/h3-4,10,14H,5-6H2,1-2H3,(H,15,16)
InChIKeyRHCPEBWQBOPOMO-UHFFFAOYSA-N
XLogP2.26
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.78
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-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

N-(5-chloro-2,4-dimethoxyphenyl)thiomorpholine-3-carboxamide
CID 82905750
N-[(5-chloro-4-methoxy-2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110793934
N-(2,4-dibromo-5-methoxyphenyl)-1,3-thiazolidine-4-carboxamide
CID 103413589
N-[(4,5-dimethoxy-2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110794315
N-(2,5-difluoro-4-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 103585937
N-(5-chloro-2-propoxyphenyl)-1,3-thiazolidine-4-carboxamide
CID 54862385
(4S)-N-(2-chlorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119261984
N-(5-bromo-2-chlorophenyl)-1,3-thiazolidine-4-carboxamide
CID 62908918
N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-1,3-thiazolidine-4-carboxamide
CID 110795767
N-(3,4-dimethylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 50988129
N-(3-tert-butyl-4-methoxyphenyl)-1,3-thiazolidine-4-carboxamide
CID 110792568
N-(2-methyl-4-propan-2-yloxyphenyl)-1,3-thiazolidine-4-carboxamide
CID 54862659

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide (CID 110792775) is N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide is COc1cc(C)c(Cl)cc1NC(=O)C1CSCN1.
What is the InChIKey of N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is RHCPEBWQBOPOMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O2S/c1-7-3-11(17-2)9(4-8(7)13)15-12(16)10-5-18-6-14-10/h3-4,10,14H,5-6H2,1-2H3,(H,15,16).
What are the key properties of N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide?
N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 286.78 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxy-4-methylphenyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 110792775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).