2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide

C14H16N2OS2 — CID 2574247

IUPAC2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CSc1nc(-c2ccccc2)cs1
InChIInChI=1S/C14H16N2OS2/c1-10(2)15-13(17)9-19-14-16-12(8-18-14)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,15,17)
InChIKeyOGCNRFYNQMRRHC-UHFFFAOYSA-N
MW292.43 g/mol
LogP3.43
Rot. Bonds5

About 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide

2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide (PubChem CID 2574247) has the molecular formula C14H16N2OS2 and a molecular weight of 292.43 g/mol. Its IUPAC name is 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide
PubChem CID2574247
Molecular FormulaC14H16N2OS2
Molecular Weight292.43 g/mol
Exact Mass292.07
IUPAC Name2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CSc1nc(-c2ccccc2)cs1
InChIInChI=1S/C14H16N2OS2/c1-10(2)15-13(17)9-19-14-16-12(8-18-14)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,15,17)
InChIKeyOGCNRFYNQMRRHC-UHFFFAOYSA-N
XLogP3.43
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide (CID 2574247) is 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide is CC(C)NC(=O)CSc1nc(-c2ccccc2)cs1.
What is the InChIKey of 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide?
The InChIKey is OGCNRFYNQMRRHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS2/c1-10(2)15-13(17)9-19-14-16-12(8-18-14)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,15,17).
What are the key properties of 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide?
2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide has a molecular weight of 292.43 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide is sourced from PubChem (CID 2574247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).