N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

C12H10Cl2N2OS — CID 19242134

IUPACN-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)Nc2ccc(Cl)cc2Cl)s1
InChIInChI=1S/C12H10Cl2N2OS/c1-6-11(18-7(2)15-6)12(17)16-10-4-3-8(13)5-9(10)14/h3-5H,1-2H3,(H,16,17)
InChIKeyNWVRKDADYGAYEE-UHFFFAOYSA-N
MW301.20 g/mol
LogP4.32
Rot. Bonds2

About N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide (PubChem CID 19242134) has the molecular formula C12H10Cl2N2OS and a molecular weight of 301.20 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
PubChem CID19242134
Molecular FormulaC12H10Cl2N2OS
Molecular Weight301.20 g/mol
Exact Mass299.99
IUPAC NameN-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)Nc2ccc(Cl)cc2Cl)s1
InChIInChI=1S/C12H10Cl2N2OS/c1-6-11(18-7(2)15-6)12(17)16-10-4-3-8(13)5-9(10)14/h3-5H,1-2H3,(H,16,17)
InChIKeyNWVRKDADYGAYEE-UHFFFAOYSA-N
XLogP4.32
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.20
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-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

N-(4-chloro-2-iodophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 103766762
5-chloro-2-[(2,4-dimethyl-1,3-thiazole-5-carbonyl)amino]benzoic acid
CID 43092330
N-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 27666998
N-(2,4-dichlorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 54102334
N-(5-chloro-2-pyridinyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 47019747
2-chloro-6-[(2,4-dimethyl-1,3-thiazole-5-carbonyl)amino]benzoic acid
CID 63724956
N'-(4-chlorobenzoyl)-2,4-dimethyl-1,3-thiazole-5-carbohydrazide
CID 2744486
2-[(2,4-dimethyl-1,3-thiazole-5-carbonyl)amino]-5-iodobenzoic acid
CID 45345743
N-(4-bromo-3-chlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 103824607
N-(4-amino-3-chlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 114034039
N-(2-chloro-4-iodophenyl)-2-ethyl-4-methyl-1,3-thiazole-5-carboxamide
CID 49325357
2-N,5-N-bis(2,4-dichlorophenyl)thiophene-2,5-dicarboxamide
CID 2329395

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide (CID 19242134) is N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide is Cc1nc(C)c(C(=O)Nc2ccc(Cl)cc2Cl)s1.
What is the InChIKey of N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The InChIKey is NWVRKDADYGAYEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2OS/c1-6-11(18-7(2)15-6)12(17)16-10-4-3-8(13)5-9(10)14/h3-5H,1-2H3,(H,16,17).
What are the key properties of N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide?
N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide has a molecular weight of 301.20 g/mol, XLogP of 4.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 19242134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).