N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide

C15H11N3O2S — CID 135979518

IUPACN-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
SMILESO=C(NO)c1sc(-c2ccncc2)nc1-c1ccccc1
InChIInChI=1S/C15H11N3O2S/c19-14(18-20)13-12(10-4-2-1-3-5-10)17-15(21-13)11-6-8-16-9-7-11/h1-9,20H,(H,18,19)
InChIKeyLSEHMONDAQVNGX-UHFFFAOYSA-N
MW297.34 g/mol
LogP2.99
Rot. Bonds3

About N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide

N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide (PubChem CID 135979518) has the molecular formula C15H11N3O2S and a molecular weight of 297.34 g/mol. Its IUPAC name is N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
PubChem CID135979518
Molecular FormulaC15H11N3O2S
Molecular Weight297.34 g/mol
Exact Mass297.06
IUPAC NameN-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
SMILESO=C(NO)c1sc(-c2ccncc2)nc1-c1ccccc1
InChIInChI=1S/C15H11N3O2S/c19-14(18-20)13-12(10-4-2-1-3-5-10)17-15(21-13)11-6-8-16-9-7-11/h1-9,20H,(H,18,19)
InChIKeyLSEHMONDAQVNGX-UHFFFAOYSA-N
XLogP2.99
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.34
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-Pyridinecarboxamide, N-(4-phenyl-2-thiazolyl)-
CID 203433
4-Phenyl-2-(4-pyridyl)thiazole-5-carboxylic acid
CID 73012807
4-Amino-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10171950
3-[2-(Pyridin-3-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10236551
N-hydroxy-5-(pyridin-2-yl)thiophene-2-carboxamide
CID 10242569
3-[2-(Pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10308461
2-Pyridin-3-yl-1,3-thiazole-4-carboxamide, N-hydroxy-
CID 604917
3-Amino-6-(pyridin-3-yl)thieno[2,3-b]pyridine-2-carboxamide
CID 766178
N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)nicotinamide
CID 804510
N-(4-tert-butylphenyl)-4-[2-(pyridin-4-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 11617549
N-(4-chlorophenyl)-4-[2-(pyridin-4-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 23644830
N-[4-(propan-2-yl)phenyl]-4-[2-(pyridin-4-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 23644838

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide (CID 135979518) is N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide is O=C(NO)c1sc(-c2ccncc2)nc1-c1ccccc1.
What is the InChIKey of N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The InChIKey is LSEHMONDAQVNGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2S/c19-14(18-20)13-12(10-4-2-1-3-5-10)17-15(21-13)11-6-8-16-9-7-11/h1-9,20H,(H,18,19).
What are the key properties of N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide has a molecular weight of 297.34 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-phenyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 135979518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).