N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide

C8H6N2O3S — CID 127027462

IUPACN-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide
SMILESO=C(NO)c1coc(-c2cccs2)n1
InChIInChI=1S/C8H6N2O3S/c11-7(10-12)5-4-13-8(9-5)6-2-1-3-14-6/h1-4,12H,(H,10,11)
InChIKeyHJQZGXABNBZCDG-UHFFFAOYSA-N
MW210.21 g/mol
LogP1.52
Rot. Bonds2

About N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide

N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide (PubChem CID 127027462) has the molecular formula C8H6N2O3S and a molecular weight of 210.21 g/mol. Its IUPAC name is N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide
PubChem CID127027462
Molecular FormulaC8H6N2O3S
Molecular Weight210.21 g/mol
Exact Mass210.01
IUPAC NameN-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide
SMILESO=C(NO)c1coc(-c2cccs2)n1
InChIInChI=1S/C8H6N2O3S/c11-7(10-12)5-4-13-8(9-5)6-2-1-3-14-6/h1-4,12H,(H,10,11)
InChIKeyHJQZGXABNBZCDG-UHFFFAOYSA-N
XLogP1.52
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 51.52
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

5-Methyl-2-(thiophen-2-yl)oxazole-4-carbaldehyde
CID 28063458
5-Amino-2-(2-thienyl)-1,3-oxazole-4-carbonitrile
CID 385626
2-methyl-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]propanamide
CID 17470996
N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]cyclopentanecarboxamide
CID 24246994
2-[(2-Thiophen-2-yl-1,3-oxazol-4-yl)methyl]-1,2-thiazolidine 1,1-dioxide
CID 45815467
N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]butane-1-sulfonamide
CID 47070155
1-(4-methylmorpholin-2-yl)-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]methanamine
CID 53591985
N,N-dimethyl-1-[4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]morpholin-2-yl]methanamine
CID 72043767
N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]heptan-2-amine
CID 46220399
2-[2-(Thiophen-2-yl)-1,3-oxazol-4-yl]acetonitrile
CID 26695420
2-(2-(Thiophen-2-yl)-1,3-oxazol-4-yl)acetic acid
CID 28287614
4-Methyl-2-thiophen-2-yl-1,3-oxazole
CID 11469274

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide (CID 127027462) is N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide is O=C(NO)c1coc(-c2cccs2)n1.
What is the InChIKey of N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The InChIKey is HJQZGXABNBZCDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O3S/c11-7(10-12)5-4-13-8(9-5)6-2-1-3-14-6/h1-4,12H,(H,10,11).
What are the key properties of N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide?
N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide has a molecular weight of 210.21 g/mol, XLogP of 1.52, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-thiophen-2-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 127027462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).