N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide

C16H13N3O2S — CID 135705051

IUPACN-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCC(=O)Nc1cc(-c2csc(-c3ccccn3)n2)ccc1O
InChIInChI=1S/C16H13N3O2S/c1-10(20)18-13-8-11(5-6-15(13)21)14-9-22-16(19-14)12-4-2-3-7-17-12/h2-9,21H,1H3,(H,18,20)
InChIKeyDSRDAFFAZFGUMJ-UHFFFAOYSA-N
MW311.37 g/mol
LogP3.54
Rot. Bonds3

About N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide

N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide (PubChem CID 135705051) has the molecular formula C16H13N3O2S and a molecular weight of 311.37 g/mol. Its IUPAC name is N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
PubChem CID135705051
Molecular FormulaC16H13N3O2S
Molecular Weight311.37 g/mol
Exact Mass311.07
IUPAC NameN-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCC(=O)Nc1cc(-c2csc(-c3ccccn3)n2)ccc1O
InChIInChI=1S/C16H13N3O2S/c1-10(20)18-13-8-11(5-6-15(13)21)14-9-22-16(19-14)12-4-2-3-7-17-12/h2-9,21H,1H3,(H,18,20)
InChIKeyDSRDAFFAZFGUMJ-UHFFFAOYSA-N
XLogP3.54
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.37
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 4822806
2,2-dimethyl-N-[4-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]propanamide
CID 9356429
N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]pyridine-2-carboxamide
CID 108748434
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
2-pyridin-2-yl-4-(2-pyridin-2-yl-1,3-thiazol-4-yl)-1,3-thiazole
CID 15542721
N-(4-acetamidophenyl)-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 48845320
N-[2-methylsulfanyl-4-(2-pyridin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 47061841
N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]cyclopropanecarboxamide
CID 108748401
N-[2-hydroxy-5-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 9421404
2-fluoro-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)aniline
CID 39164031
4-bromo-N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108748532

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The IUPAC name of N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide (CID 135705051) is N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide.
What is the SMILES notation for N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The canonical SMILES for N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide is CC(=O)Nc1cc(-c2csc(-c3ccccn3)n2)ccc1O.
What is the InChIKey of N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The InChIKey is DSRDAFFAZFGUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2S/c1-10(20)18-13-8-11(5-6-15(13)21)14-9-22-16(19-14)12-4-2-3-7-17-12/h2-9,21H,1H3,(H,18,20).
What are the key properties of N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide?
N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide has a molecular weight of 311.37 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-5-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 135705051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).