2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide

C18H17N3O2S — CID 154725794

IUPAC2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide
SMILESCOc1ccc(-c2csc(CC(=O)Nc3cnccc3C)n2)cc1
InChIInChI=1S/C18H17N3O2S/c1-12-7-8-19-10-15(12)20-17(22)9-18-21-16(11-24-18)13-3-5-14(23-2)6-4-13/h3-8,10-11H,9H2,1-2H3,(H,20,22)
InChIKeyZGRVQVUGVRLEQE-UHFFFAOYSA-N
MW339.42 g/mol
LogP3.70
Rot. Bonds5

About 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide

2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide (PubChem CID 154725794) has the molecular formula C18H17N3O2S and a molecular weight of 339.42 g/mol. Its IUPAC name is 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide
PubChem CID154725794
Molecular FormulaC18H17N3O2S
Molecular Weight339.42 g/mol
Exact Mass339.10
IUPAC Name2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide
SMILESCOc1ccc(-c2csc(CC(=O)Nc3cnccc3C)n2)cc1
InChIInChI=1S/C18H17N3O2S/c1-12-7-8-19-10-15(12)20-17(22)9-18-21-16(11-24-18)13-3-5-14(23-2)6-4-13/h3-8,10-11H,9H2,1-2H3,(H,20,22)
InChIKeyZGRVQVUGVRLEQE-UHFFFAOYSA-N
XLogP3.70
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylphenyl)-2-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
CID 8963676
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 8963664
N-(4-methoxyphenyl)-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide
CID 110650248
N-(2-methylphenyl)-2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]acetamide
CID 8963536
2-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-(4-methoxy-2-methylphenyl)acetamide
CID 62872274
2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methylphenyl)acetamide
CID 8962794
2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 9420940
N-[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethyl]-2-methylpropanamide
CID 39071665
2-[4-[4-(difluoromethoxy)-3-methoxyphenyl]-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 9343710
N-(2-methoxy-5-methylphenyl)-3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 110422465
N-(2,4-dimethylphenyl)-2-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]acetamide
CID 17473073
3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-[(2-methylphenyl)methyl]propanamide
CID 110409063

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide?
The IUPAC name of 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide (CID 154725794) is 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide?
The canonical SMILES for 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide is COc1ccc(-c2csc(CC(=O)Nc3cnccc3C)n2)cc1.
What is the InChIKey of 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide?
The InChIKey is ZGRVQVUGVRLEQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2S/c1-12-7-8-19-10-15(12)20-17(22)9-18-21-16(11-24-18)13-3-5-14(23-2)6-4-13/h3-8,10-11H,9H2,1-2H3,(H,20,22).
What are the key properties of 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide?
2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide has a molecular weight of 339.42 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 154725794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).