2-phenyl-2-(1,3-thiazol-2-yl)propanamide

C12H12N2OS — CID 67042074

IUPAC2-phenyl-2-(1,3-thiazol-2-yl)propanamide
SMILESCC(C(N)=O)(c1ccccc1)c1nccs1
InChIInChI=1S/C12H12N2OS/c1-12(10(13)15,11-14-7-8-16-11)9-5-3-2-4-6-9/h2-8H,1H3,(H2,13,15)
InChIKeyNPHAMOOVUFAAST-UHFFFAOYSA-N
MW232.31 g/mol
LogP1.93
Rot. Bonds3

About 2-phenyl-2-(1,3-thiazol-2-yl)propanamide

2-phenyl-2-(1,3-thiazol-2-yl)propanamide (PubChem CID 67042074) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is 2-phenyl-2-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name2-phenyl-2-(1,3-thiazol-2-yl)propanamide
PubChem CID67042074
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC Name2-phenyl-2-(1,3-thiazol-2-yl)propanamide
SMILESCC(C(N)=O)(c1ccccc1)c1nccs1
InChIInChI=1S/C12H12N2OS/c1-12(10(13)15,11-14-7-8-16-11)9-5-3-2-4-6-9/h2-8H,1H3,(H2,13,15)
InChIKeyNPHAMOOVUFAAST-UHFFFAOYSA-N
XLogP1.93
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-2-(1,3-thiazol-2-yl)propanoic acid
CID 66644727
ethyl 2-hydroxy-2-phenyl-2-(1,3-thiazol-2-yl)acetate
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2-phenyl-2-pyrimidin-5-ylpropanamide
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2-phenyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]acetamide
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CID 119953291
2-amino-2-phenyl-N-[1-(1,3-thiazol-2-yl)propyl]propanamide;dihydrochloride
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tert-butylbenzene;S-(1,3-thiazol-2-yl)thiohydroxylamine
CID 174963033
N-(2-methyl-2-phenylpropyl)-1,3-thiazole-2-carboxamide
CID 110467972
cyclohexyl-phenyl-(1,3-thiazol-2-yl)methanol
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methyl 4-[2-(1,3-thiazol-2-yl)propan-2-yl]benzoate
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CID 66098936

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 2-phenyl-2-(1,3-thiazol-2-yl)propanamide (CID 67042074) is 2-phenyl-2-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 2-phenyl-2-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 2-phenyl-2-(1,3-thiazol-2-yl)propanamide is CC(C(N)=O)(c1ccccc1)c1nccs1.
What is the InChIKey of 2-phenyl-2-(1,3-thiazol-2-yl)propanamide?
The InChIKey is NPHAMOOVUFAAST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS/c1-12(10(13)15,11-14-7-8-16-11)9-5-3-2-4-6-9/h2-8H,1H3,(H2,13,15).
What are the key properties of 2-phenyl-2-(1,3-thiazol-2-yl)propanamide?
2-phenyl-2-(1,3-thiazol-2-yl)propanamide has a molecular weight of 232.31 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 67042074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).