N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide

C15H16N2O2S — CID 2500763

IUPACN-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide
SMILESCCNC(=O)NC(=O)CSc1ccc2ccccc2c1
InChIInChI=1S/C15H16N2O2S/c1-2-16-15(19)17-14(18)10-20-13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,2,10H2,1H3,(H2,16,17,18,19)
InChIKeyGMPSSPMPRWCRTJ-UHFFFAOYSA-N
MW288.37 g/mol
LogP2.78
Rot. Bonds4

About N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide

N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide (PubChem CID 2500763) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide
PubChem CID2500763
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC NameN-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide
SMILESCCNC(=O)NC(=O)CSc1ccc2ccccc2c1
InChIInChI=1S/C15H16N2O2S/c1-2-16-15(19)17-14(18)10-20-13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,2,10H2,1H3,(H2,16,17,18,19)
InChIKeyGMPSSPMPRWCRTJ-UHFFFAOYSA-N
XLogP2.78
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide?
The IUPAC name of N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide (CID 2500763) is N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide is CCNC(=O)NC(=O)CSc1ccc2ccccc2c1.
What is the InChIKey of N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide?
The InChIKey is GMPSSPMPRWCRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-2-16-15(19)17-14(18)10-20-13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,2,10H2,1H3,(H2,16,17,18,19).
What are the key properties of N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide?
N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide has a molecular weight of 288.37 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide is sourced from PubChem (CID 2500763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).