N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide

C19H22N2O2S — CID 17431041

IUPACN-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)NC(=O)NC1CCCCC1
InChIInChI=1S/C19H22N2O2S/c22-18(21-19(23)20-16-8-2-1-3-9-16)13-24-17-11-10-14-6-4-5-7-15(14)12-17/h4-7,10-12,16H,1-3,8-9,13H2,(H2,20,21,22,23)
InChIKeyIRCCQGAPGYFBCW-UHFFFAOYSA-N
MW342.46 g/mol
LogP4.09
Rot. Bonds4

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

N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide (PubChem CID 17431041) has the molecular formula C19H22N2O2S and a molecular weight of 342.46 g/mol. Its IUPAC name is N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide
PubChem CID17431041
Molecular FormulaC19H22N2O2S
Molecular Weight342.46 g/mol
Exact Mass342.14
IUPAC NameN-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)NC(=O)NC1CCCCC1
InChIInChI=1S/C19H22N2O2S/c22-18(21-19(23)20-16-8-2-1-3-9-16)13-24-17-11-10-14-6-4-5-7-15(14)12-17/h4-7,10-12,16H,1-3,8-9,13H2,(H2,20,21,22,23)
InChIKeyIRCCQGAPGYFBCW-UHFFFAOYSA-N
XLogP4.09
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.46
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-aminophenyl)sulfanyl-N-(cyclopentylcarbamoyl)acetamide
CID 43299295
[2-(cyclooctylamino)-2-oxoethyl] 2-naphthalen-2-ylsulfanylacetate
CID 16525634
N-cycloheptyl-2-(4-methoxyphenyl)sulfanylacetamide
CID 7992638
N-(1-ethylpiperidin-1-ium-4-yl)-2-naphthalen-2-ylsulfanylacetamide
CID 9091102
1-cyclohexyl-3-[1-(2-phenylsulfanylacetyl)piperidin-4-yl]urea
CID 47070919
2-(4-chlorophenyl)sulfanyl-N-cyclododecylacetamide
CID 19203546
N-cyclohexyl-2-(4-methylphenyl)sulfanylacetamide
CID 846420
N-(cyclohexylcarbamoyl)-2-[(2S)-2-hydroxy-2-phenylethyl]sulfanylacetamide
CID 94813876
2-naphthalen-2-ylsulfanyl-N-(prop-2-enylcarbamoyl)acetamide
CID 8006187
N-(cyclohexylcarbamoyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide
CID 7415704
(2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide
CID 7402929
2-(4-aminophenyl)sulfanyl-N-cyclopentylacetamide
CID 19317767

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide?
The IUPAC name of N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide (CID 17431041) is N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide.
What is the SMILES notation for N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide?
The canonical SMILES for N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide is O=C(CSc1ccc2ccccc2c1)NC(=O)NC1CCCCC1.
What is the InChIKey of N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide?
The InChIKey is IRCCQGAPGYFBCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2S/c22-18(21-19(23)20-16-8-2-1-3-9-16)13-24-17-11-10-14-6-4-5-7-15(14)12-17/h4-7,10-12,16H,1-3,8-9,13H2,(H2,20,21,22,23).
What are the key properties of N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide?
N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide has a molecular weight of 342.46 g/mol, XLogP of 4.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide is sourced from PubChem (CID 17431041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).