2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide

C14H16N2OS — CID 16760027

IUPAC2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCC(C)c1cnc(NC(=O)Cc2ccccc2)s1
InChIInChI=1S/C14H16N2OS/c1-10(2)12-9-15-14(18-12)16-13(17)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,15,16,17)
InChIKeyIGRZXNLKVUEFDM-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.45
Rot. Bonds4

About 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide

2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 16760027) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide
PubChem CID16760027
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCC(C)c1cnc(NC(=O)Cc2ccccc2)s1
InChIInChI=1S/C14H16N2OS/c1-10(2)12-9-15-14(18-12)16-13(17)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,15,16,17)
InChIKeyIGRZXNLKVUEFDM-UHFFFAOYSA-N
XLogP3.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide (CID 16760027) is 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide is CC(C)c1cnc(NC(=O)Cc2ccccc2)s1.
What is the InChIKey of 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide?
The InChIKey is IGRZXNLKVUEFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-10(2)12-9-15-14(18-12)16-13(17)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,15,16,17).
What are the key properties of 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide?
2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 260.36 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 16760027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).