N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide

C15H14N2OS2 — CID 7534956

IUPACN-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)NC1=NCCS1
InChIInChI=1S/C15H14N2OS2/c18-14(17-15-16-7-8-19-15)10-20-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9H,7-8,10H2,(H,16,17,18)
InChIKeyLGXROCAQYLWHBF-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.15
Rot. Bonds3

About N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide

N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide (PubChem CID 7534956) has the molecular formula C15H14N2OS2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide
PubChem CID7534956
Molecular FormulaC15H14N2OS2
Molecular Weight302.42 g/mol
Exact Mass302.05
IUPAC NameN-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)NC1=NCCS1
InChIInChI=1S/C15H14N2OS2/c18-14(17-15-16-7-8-19-15)10-20-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9H,7-8,10H2,(H,16,17,18)
InChIKeyLGXROCAQYLWHBF-UHFFFAOYSA-N
XLogP3.15
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-naphthalen-2-ylsulfanyl-N-pyrimidin-2-ylacetamide
CID 2358893
2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide
CID 39922635
N-(4-chlorophenyl)-2-naphthalen-2-ylsulfanylacetamide
CID 4560101
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(2-phenylindol-1-yl)acetamide
CID 8832224
N-[3-(carbamoylamino)phenyl]-2-naphthalen-2-ylsulfanylacetamide
CID 55539737
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 50853062
N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-naphthalen-2-ylsulfanylacetamide
CID 7402808
3-[(2-naphthalen-2-ylsulfanylacetyl)amino]benzoic acid
CID 45425864
2-(2-chloroanilino)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
CID 95257494
2-(3,4-difluorophenyl)sulfanyl-N-naphthalen-2-ylacetamide
CID 7736930
N-(3,5-dichloro-6-methyl-2-pyridinyl)-2-naphthalen-2-ylsulfanylacetamide
CID 7793089
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
CID 4963856

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide?
The IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide (CID 7534956) is N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide.
What is the SMILES notation for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide?
The canonical SMILES for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide is O=C(CSc1ccc2ccccc2c1)NC1=NCCS1.
What is the InChIKey of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide?
The InChIKey is LGXROCAQYLWHBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS2/c18-14(17-15-16-7-8-19-15)10-20-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9H,7-8,10H2,(H,16,17,18).
What are the key properties of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide?
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide has a molecular weight of 302.42 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide is sourced from PubChem (CID 7534956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).