3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide

C19H15N3O2S2 — CID 16592790

IUPAC3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)Nc1nc(-c2cccs2)cs1
InChIInChI=1S/C19H15N3O2S2/c23-17(22-19-21-14(12-26-19)16-7-4-10-25-16)8-9-18-20-11-15(24-18)13-5-2-1-3-6-13/h1-7,10-12H,8-9H2,(H,21,22,23)
InChIKeyNNAGTZRKFNYTIK-UHFFFAOYSA-N
MW381.48 g/mol
LogP5.10
Rot. Bonds6

About 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide

3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide (PubChem CID 16592790) has the molecular formula C19H15N3O2S2 and a molecular weight of 381.48 g/mol. Its IUPAC name is 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide
PubChem CID16592790
Molecular FormulaC19H15N3O2S2
Molecular Weight381.48 g/mol
Exact Mass381.06
IUPAC Name3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)Nc1nc(-c2cccs2)cs1
InChIInChI=1S/C19H15N3O2S2/c23-17(22-19-21-14(12-26-19)16-7-4-10-25-16)8-9-18-20-11-15(24-18)13-5-2-1-3-6-13/h1-7,10-12H,8-9H2,(H,21,22,23)
InChIKeyNNAGTZRKFNYTIK-UHFFFAOYSA-N
XLogP5.10
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.48
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 32868601
N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 16594029
N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 29499487
3-(5-phenyl-1,3-oxazol-2-yl)-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]propanamide
CID 30185079
3-(2-ethoxyphenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide
CID 55381245
N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-4-(5-phenyl-1,3-oxazol-2-yl)butanamide
CID 38937145
3-(benzenesulfonyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide
CID 7189641
N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propanamide
CID 16597617
3-(5-phenyl-1,3-oxazol-2-yl)-N-[3-(1,3-thiazol-2-yl)phenyl]propanamide
CID 55991737
N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51311777
3,3-diphenyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide
CID 4171293
4-(2-fluorophenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)butanamide
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Frequently Asked Questions

What is the IUPAC name of 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide (CID 16592790) is 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide is O=C(CCc1ncc(-c2ccccc2)o1)Nc1nc(-c2cccs2)cs1.
What is the InChIKey of 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide?
The InChIKey is NNAGTZRKFNYTIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2S2/c23-17(22-19-21-14(12-26-19)16-7-4-10-25-16)8-9-18-20-11-15(24-18)13-5-2-1-3-6-13/h1-7,10-12H,8-9H2,(H,21,22,23).
What are the key properties of 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide?
3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide has a molecular weight of 381.48 g/mol, XLogP of 5.10, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-phenyl-1,3-oxazol-2-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 16592790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).