N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide

C18H15FN2OS — CID 2548953

IUPACN-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
SMILESCc1ccc(NC(=O)Cc2csc(-c3ccccc3)n2)cc1F
InChIInChI=1S/C18H15FN2OS/c1-12-7-8-14(9-16(12)19)20-17(22)10-15-11-23-18(21-15)13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H,20,22)
InChIKeyNGWQYCAOKPGVNO-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.44
Rot. Bonds4

About N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide

N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide (PubChem CID 2548953) has the molecular formula C18H15FN2OS and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
PubChem CID2548953
Molecular FormulaC18H15FN2OS
Molecular Weight326.40 g/mol
Exact Mass326.09
IUPAC NameN-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
SMILESCc1ccc(NC(=O)Cc2csc(-c3ccccc3)n2)cc1F
InChIInChI=1S/C18H15FN2OS/c1-12-7-8-14(9-16(12)19)20-17(22)10-15-11-23-18(21-15)13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H,20,22)
InChIKeyNGWQYCAOKPGVNO-UHFFFAOYSA-N
XLogP4.44
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 519881
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CID 10149743
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CID 10149755
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CID 10286404
CID 10286404
CID 10287269
CID 10287269
CID 10309171
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CID 7119106
CID 7119106
CID 233871
CID 233871
CID 685913
CID 685913
CID 790687
CID 790687
CID 22638512
CID 22638512
CID 22638559
CID 22638559

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide (CID 2548953) is N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide is Cc1ccc(NC(=O)Cc2csc(-c3ccccc3)n2)cc1F.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is NGWQYCAOKPGVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2OS/c1-12-7-8-14(9-16(12)19)20-17(22)10-15-11-23-18(21-15)13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H,20,22).
What are the key properties of N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide?
N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 326.40 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 2548953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).