N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide

C17H11N3O2S2 — CID 166186361

IUPACN-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide
SMILESO=C(Nc1ccc(-c2cnco2)cc1)c1cnc(-c2cccs2)s1
InChIInChI=1S/C17H11N3O2S2/c21-16(15-9-19-17(24-15)14-2-1-7-23-14)20-12-5-3-11(4-6-12)13-8-18-10-22-13/h1-10H,(H,20,21)
InChIKeyANXPQBXCKOWEOX-UHFFFAOYSA-N
MW353.43 g/mol
LogP4.78
Rot. Bonds4

About N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide

N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide (PubChem CID 166186361) has the molecular formula C17H11N3O2S2 and a molecular weight of 353.43 g/mol. Its IUPAC name is N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide
PubChem CID166186361
Molecular FormulaC17H11N3O2S2
Molecular Weight353.43 g/mol
Exact Mass353.03
IUPAC NameN-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide
SMILESO=C(Nc1ccc(-c2cnco2)cc1)c1cnc(-c2cccs2)s1
InChIInChI=1S/C17H11N3O2S2/c21-16(15-9-19-17(24-15)14-2-1-7-23-14)20-12-5-3-11(4-6-12)13-8-18-10-22-13/h1-10H,(H,20,21)
InChIKeyANXPQBXCKOWEOX-UHFFFAOYSA-N
XLogP4.78
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-bromo-N-[4-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide
CID 61216626
2-thiophen-2-yl-1,3-thiazole-5-carboxamide
CID 130667272
2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 62788932
4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 60811320
6-chloro-N-[4-(1,3-oxazol-5-yl)phenyl]pyridine-2-carboxamide
CID 62233090
4-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 78890221
4-chloro-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide
CID 63307748
3-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 60810765
N-[4-(1,3-oxazol-5-yl)phenyl]-3-(tetrazol-1-yl)thiophene-2-carboxamide
CID 87008522
5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide
CID 47265686
2,2-dimethyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 2806322
4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]-1,2,5-oxadiazole-3-carboxamide
CID 62688151

Frequently Asked Questions

What is the IUPAC name of N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide (CID 166186361) is N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide is O=C(Nc1ccc(-c2cnco2)cc1)c1cnc(-c2cccs2)s1.
What is the InChIKey of N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide?
The InChIKey is ANXPQBXCKOWEOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3O2S2/c21-16(15-9-19-17(24-15)14-2-1-7-23-14)20-12-5-3-11(4-6-12)13-8-18-10-22-13/h1-10H,(H,20,21).
What are the key properties of N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide?
N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1,3-oxazol-5-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 166186361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).