N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide

C15H26N2O2S — CID 8705522

IUPACN-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide
SMILESO=C(CSC1CCCCC1)NC(=O)NC1CCCCC1
InChIInChI=1S/C15H26N2O2S/c18-14(11-20-13-9-5-2-6-10-13)17-15(19)16-12-7-3-1-4-8-12/h12-13H,1-11H2,(H2,16,17,18,19)
InChIKeyHLGQXSFLPBGEBM-UHFFFAOYSA-N
MW298.45 g/mol
LogP3.21
Rot. Bonds4

About N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide

N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide (PubChem CID 8705522) has the molecular formula C15H26N2O2S and a molecular weight of 298.45 g/mol. Its IUPAC name is N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide.

Molecular Properties

Compound NameN-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide
PubChem CID8705522
Molecular FormulaC15H26N2O2S
Molecular Weight298.45 g/mol
Exact Mass298.17
IUPAC NameN-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide
SMILESO=C(CSC1CCCCC1)NC(=O)NC1CCCCC1
InChIInChI=1S/C15H26N2O2S/c18-14(11-20-13-9-5-2-6-10-13)17-15(19)16-12-7-3-1-4-8-12/h12-13H,1-11H2,(H2,16,17,18,19)
InChIKeyHLGQXSFLPBGEBM-UHFFFAOYSA-N
XLogP3.21
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.45
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 16769602
2-chloro-N-(cyclooctylcarbamoyl)acetamide
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CID 2424051
2-(azepan-1-yl)-N-(cyclopentylcarbamoyl)acetamide
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[2-(cyclohexylcarbamoylamino)-2-oxoethyl]-cyclooctylazanium
CID 9265087
[2-(cyclopentylcarbamoylamino)-2-oxoethyl] N'-aminocarbamimidothioate
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N-(cyclohexylcarbamoyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide
CID 7415704
N-(1-adamantylcarbamoyl)-2-cyclopentylsulfanylacetamide
CID 4821581
6-(cyclohexylcarbamoylamino)-6-oxohexanoic acid
CID 43447271
2-(4-aminophenyl)sulfanyl-N-(cyclopentylcarbamoyl)acetamide
CID 43299295
2-[[4-amino-5-[2-(cyclopentylcarbamoylamino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclopentylcarbamoyl)acetamide
CID 4845048
N-(cyclohexylcarbamoyl)-2-naphthalen-2-ylsulfanylacetamide
CID 17431041

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide?
The IUPAC name of N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide (CID 8705522) is N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide.
What is the SMILES notation for N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide?
The canonical SMILES for N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide is O=C(CSC1CCCCC1)NC(=O)NC1CCCCC1.
What is the InChIKey of N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide?
The InChIKey is HLGQXSFLPBGEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2S/c18-14(11-20-13-9-5-2-6-10-13)17-15(19)16-12-7-3-1-4-8-12/h12-13H,1-11H2,(H2,16,17,18,19).
What are the key properties of N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide?
N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide has a molecular weight of 298.45 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylcarbamoyl)-2-cyclohexylsulfanylacetamide is sourced from PubChem (CID 8705522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).