2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide

C17H13Cl2N3O2S — CID 37025669

IUPAC2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCc1nc(NC(=O)COc2ccc(Cl)c(Cl)c2)sc1-c1ccccn1
InChIInChI=1S/C17H13Cl2N3O2S/c1-10-16(14-4-2-3-7-20-14)25-17(21-10)22-15(23)9-24-11-5-6-12(18)13(19)8-11/h2-8H,9H2,1H3,(H,21,22,23)
InChIKeyDSPIJJAXNJXXSM-UHFFFAOYSA-N
MW394.28 g/mol
LogP4.84
Rot. Bonds5

About 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide

2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 37025669) has the molecular formula C17H13Cl2N3O2S and a molecular weight of 394.28 g/mol. Its IUPAC name is 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
PubChem CID37025669
Molecular FormulaC17H13Cl2N3O2S
Molecular Weight394.28 g/mol
Exact Mass393.01
IUPAC Name2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCc1nc(NC(=O)COc2ccc(Cl)c(Cl)c2)sc1-c1ccccn1
InChIInChI=1S/C17H13Cl2N3O2S/c1-10-16(14-4-2-3-7-20-14)25-17(21-10)22-15(23)9-24-11-5-6-12(18)13(19)8-11/h2-8H,9H2,1H3,(H,21,22,23)
InChIKeyDSPIJJAXNJXXSM-UHFFFAOYSA-N
XLogP4.84
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.28
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide 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

2-(4-chlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
CID 17484768
4-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31154800
N-(4,7-dichloro-1,3-benzothiazol-2-yl)-2-(3-methylphenoxy)acetamide
CID 43988847
N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 31519206
2-(4-chloro-3-methylphenoxy)-N-pyridin-2-ylacetamide
CID 883765
N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 31154524
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
CID 31156282
2,6-difluoro-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31171489
N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-2-naphthalen-2-yloxyacetamide
CID 4237233
6-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 31519632
2-(4-chloro-3-methylphenoxy)-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]acetamide
CID 16547898
(E)-3-(3-methoxyphenyl)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)prop-2-enamide
CID 31171502

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide (CID 37025669) is 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide is Cc1nc(NC(=O)COc2ccc(Cl)c(Cl)c2)sc1-c1ccccn1.
What is the InChIKey of 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The InChIKey is DSPIJJAXNJXXSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2N3O2S/c1-10-16(14-4-2-3-7-20-14)25-17(21-10)22-15(23)9-24-11-5-6-12(18)13(19)8-11/h2-8H,9H2,1H3,(H,21,22,23).
What are the key properties of 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 394.28 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenoxy)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 37025669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).