N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide

C16H13N3OS — CID 4822806

IUPACN-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2csc(-c3ccccn3)n2)cc1
InChIInChI=1S/C16H13N3OS/c1-11(20)18-13-7-5-12(6-8-13)15-10-21-16(19-15)14-4-2-3-9-17-14/h2-10H,1H3,(H,18,20)
InChIKeyMVUUJMHQHUFTBU-UHFFFAOYSA-N
MW295.37 g/mol
LogP3.83
Rot. Bonds3

About N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide

N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide (PubChem CID 4822806) has the molecular formula C16H13N3OS and a molecular weight of 295.37 g/mol. Its IUPAC name is N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
PubChem CID4822806
Molecular FormulaC16H13N3OS
Molecular Weight295.37 g/mol
Exact Mass295.08
IUPAC NameN-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2csc(-c3ccccn3)n2)cc1
InChIInChI=1S/C16H13N3OS/c1-11(20)18-13-7-5-12(6-8-13)15-10-21-16(19-15)14-4-2-3-9-17-14/h2-10H,1H3,(H,18,20)
InChIKeyMVUUJMHQHUFTBU-UHFFFAOYSA-N
XLogP3.83
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.37
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]propanamide
CID 9356429
N-(4-acetamidophenyl)-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 48845320
N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 135705051
[2-(4-acetamidoanilino)-2-oxoethyl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetate
CID 30253480
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
CID 60523451
[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]boronic acid
CID 99738175
N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]pyridine-2-carboxamide
CID 108748434
2-pyridin-2-yl-4-(2-pyridin-2-yl-1,3-thiazol-4-yl)-1,3-thiazole
CID 15542721
N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108748438
4-phenyl-N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108770359
N-[4-[2-(methylamino)-1,3-thiazol-4-yl]phenyl]acetamide
CID 4820967
N-(4-ethylphenyl)-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 110649811

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The IUPAC name of N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide (CID 4822806) is N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide.
What is the SMILES notation for N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The canonical SMILES for N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2csc(-c3ccccn3)n2)cc1.
What is the InChIKey of N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The InChIKey is MVUUJMHQHUFTBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3OS/c1-11(20)18-13-7-5-12(6-8-13)15-10-21-16(19-15)14-4-2-3-9-17-14/h2-10H,1H3,(H,18,20).
What are the key properties of N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide?
N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide has a molecular weight of 295.37 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 4822806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).