N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide

C15H15Cl2N3OS — CID 42781193

IUPACN-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide
SMILESCn1cccc1C1SCCN1C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C15H15Cl2N3OS/c1-19-7-3-6-12(19)14-20(8-9-22-14)15(21)18-11-5-2-4-10(16)13(11)17/h2-7,14H,8-9H2,1H3,(H,18,21)
InChIKeyHLFWMVIBBREUCA-UHFFFAOYSA-N
MW356.28 g/mol
LogP4.61
Rot. Bonds2

About N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide

N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide (PubChem CID 42781193) has the molecular formula C15H15Cl2N3OS and a molecular weight of 356.28 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide
PubChem CID42781193
Molecular FormulaC15H15Cl2N3OS
Molecular Weight356.28 g/mol
Exact Mass355.03
IUPAC NameN-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide
SMILESCn1cccc1C1SCCN1C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C15H15Cl2N3OS/c1-19-7-3-6-12(19)14-20(8-9-22-14)15(21)18-11-5-2-4-10(16)13(11)17/h2-7,14H,8-9H2,1H3,(H,18,21)
InChIKeyHLFWMVIBBREUCA-UHFFFAOYSA-N
XLogP4.61
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.28
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7288804
N-(2,3-dichlorophenyl)-2-(2,3-dimethoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 4200428
(2S)-2-(2,3-dichlorophenyl)-N-(2-methylphenyl)-1,3-thiazolidine-3-carboxamide
CID 7495293
N-(4-cyanophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide
CID 4575110
(2S)-N-(2,3-dichlorophenyl)-2-(2,5-dimethoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 7328188
2-(2,3-dichlorophenyl)-N-(2-ethylphenyl)-1,3-thiazolidine-3-carboxamide
CID 5211788
(2R)-2-(2,3-dichlorophenyl)-N-(4-propan-2-ylphenyl)-1,3-thiazolidine-3-carboxamide
CID 7416385
N-tert-butyl-2-(2,3-dichlorophenyl)-1,3-thiazolidine-3-carboxamide
CID 3636809
[2-(1-methylpyrrol-2-yl)-1,3-thiazolidin-3-yl]-naphthalen-2-ylmethanone
CID 3446763
2-[1-[(2,3-dichlorophenyl)carbamoyl]azetidin-3-yl]propanoic acid
CID 116682846
(2R)-2-(3-chlorophenyl)-N-(2,6-dichlorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7226698
(2R)-N-(2,6-dichlorophenyl)-2-(4-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7283743

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide (CID 42781193) is N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide is Cn1cccc1C1SCCN1C(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide?
The InChIKey is HLFWMVIBBREUCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2N3OS/c1-19-7-3-6-12(19)14-20(8-9-22-14)15(21)18-11-5-2-4-10(16)13(11)17/h2-7,14H,8-9H2,1H3,(H,18,21).
What are the key properties of N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide?
N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide has a molecular weight of 356.28 g/mol, XLogP of 4.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide is sourced from PubChem (CID 42781193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).