N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide

C21H16N2O2S — CID 3647343

IUPACN-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1nc(-c2ccc3ccccc3c2)cs1
InChIInChI=1S/C21H16N2O2S/c24-20(13-25-18-8-2-1-3-9-18)23-21-22-19(14-26-21)17-11-10-15-6-4-5-7-16(15)12-17/h1-12,14H,13H2,(H,22,23,24)
InChIKeyJBISIQICSHHSSU-UHFFFAOYSA-N
MW360.44 g/mol
LogP4.98
Rot. Bonds5

About N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide

N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide (PubChem CID 3647343) has the molecular formula C21H16N2O2S and a molecular weight of 360.44 g/mol. Its IUPAC name is N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide
PubChem CID3647343
Molecular FormulaC21H16N2O2S
Molecular Weight360.44 g/mol
Exact Mass360.09
IUPAC NameN-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1nc(-c2ccc3ccccc3c2)cs1
InChIInChI=1S/C21H16N2O2S/c24-20(13-25-18-8-2-1-3-9-18)23-21-22-19(14-26-21)17-11-10-15-6-4-5-7-16(15)12-17/h1-12,14H,13H2,(H,22,23,24)
InChIKeyJBISIQICSHHSSU-UHFFFAOYSA-N
XLogP4.98
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-naphthalen-2-yloxy-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide
CID 3973055
2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide
CID 7917274
N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide
CID 28861376
2-chloro-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide
CID 3513866
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-(4-phenylphenoxy)acetamide
CID 19178667
N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-2-naphthalen-2-yloxyacetamide
CID 7583100
[2-[(4-naphthalen-2-yl-1,3-thiazol-2-yl)amino]-2-oxoethyl] pyridine-3-carboxylate
CID 23915714
N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
CID 33166774
2-(4-tert-butylphenoxy)-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
CID 19178615
2-(3-bromophenoxy)-N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]acetamide
CID 19196817
(2S)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxybutanamide
CID 40538671
1-N,4-N-bis(4-naphthalen-2-yl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 5130675

Frequently Asked Questions

What is the IUPAC name of N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide?
The IUPAC name of N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide (CID 3647343) is N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide.
What is the SMILES notation for N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide?
The canonical SMILES for N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide is O=C(COc1ccccc1)Nc1nc(-c2ccc3ccccc3c2)cs1.
What is the InChIKey of N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide?
The InChIKey is JBISIQICSHHSSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O2S/c24-20(13-25-18-8-2-1-3-9-18)23-21-22-19(14-26-21)17-11-10-15-6-4-5-7-16(15)12-17/h1-12,14H,13H2,(H,22,23,24).
What are the key properties of N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide?
N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide has a molecular weight of 360.44 g/mol, XLogP of 4.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-2-phenoxyacetamide is sourced from PubChem (CID 3647343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).