N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide

C18H16N2O2S — CID 16849339

IUPACN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide
SMILESCC(=O)c1sc(NC(=O)Cc2ccc3ccccc3c2)nc1C
InChIInChI=1S/C18H16N2O2S/c1-11-17(12(2)21)23-18(19-11)20-16(22)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9H,10H2,1-2H3,(H,19,20,22)
InChIKeyXTERUINAMQPJJC-UHFFFAOYSA-N
MW324.41 g/mol
LogP3.99
Rot. Bonds4

About N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide

N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide (PubChem CID 16849339) has the molecular formula C18H16N2O2S and a molecular weight of 324.41 g/mol. Its IUPAC name is N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide
PubChem CID16849339
Molecular FormulaC18H16N2O2S
Molecular Weight324.41 g/mol
Exact Mass324.09
IUPAC NameN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide
SMILESCC(=O)c1sc(NC(=O)Cc2ccc3ccccc3c2)nc1C
InChIInChI=1S/C18H16N2O2S/c1-11-17(12(2)21)23-18(19-11)20-16(22)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9H,10H2,1-2H3,(H,19,20,22)
InChIKeyXTERUINAMQPJJC-UHFFFAOYSA-N
XLogP3.99
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.41
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-2-[(2-phenylacetyl)amino]-1,3-thiazole-5-carboxylic acid
CID 28803701
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-phenylsulfanylacetamide
CID 7254698
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)propanamide
CID 19183925
4-methyl-N'-(2-naphthalen-2-ylacetyl)-2-phenyl-1,3-thiazole-5-carbohydrazide
CID 9418607
N-(4-acetamidophenyl)-2-naphthalen-2-ylacetamide
CID 26499620
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-ylacetamide
CID 26197141
N-(4-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 16849660
N-[3,5-bis[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 67257199
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(4-ethoxyphenoxy)acetamide
CID 19177786
N-(4-methylphenyl)-2-naphthalen-2-ylacetamide
CID 9411639
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2-chlorophenoxy)acetamide
CID 19178556
N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-naphthalen-2-ylacetamide
CID 16849433

Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide?
The IUPAC name of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide (CID 16849339) is N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide is CC(=O)c1sc(NC(=O)Cc2ccc3ccccc3c2)nc1C.
What is the InChIKey of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide?
The InChIKey is XTERUINAMQPJJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2S/c1-11-17(12(2)21)23-18(19-11)20-16(22)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9H,10H2,1-2H3,(H,19,20,22).
What are the key properties of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide?
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide has a molecular weight of 324.41 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 16849339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).