2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide

C11H21NOS — CID 18360983

IUPAC2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide
SMILESCSCCNC(=O)CC1CCCCC1
InChIInChI=1S/C11H21NOS/c1-14-8-7-12-11(13)9-10-5-3-2-4-6-10/h10H,2-9H2,1H3,(H,12,13)
InChIKeyFAUXRZMKZXYIMG-UHFFFAOYSA-N
MW215.36 g/mol
LogP2.44
Rot. Bonds5

About 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide

2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide (PubChem CID 18360983) has the molecular formula C11H21NOS and a molecular weight of 215.36 g/mol. Its IUPAC name is 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide
PubChem CID18360983
Molecular FormulaC11H21NOS
Molecular Weight215.36 g/mol
Exact Mass215.13
IUPAC Name2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide
SMILESCSCCNC(=O)CC1CCCCC1
InChIInChI=1S/C11H21NOS/c1-14-8-7-12-11(13)9-10-5-3-2-4-6-10/h10H,2-9H2,1H3,(H,12,13)
InChIKeyFAUXRZMKZXYIMG-UHFFFAOYSA-N
XLogP2.44
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.36
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide?
The IUPAC name of 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide (CID 18360983) is 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide.
What is the SMILES notation for 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide?
The canonical SMILES for 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide is CSCCNC(=O)CC1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide?
The InChIKey is FAUXRZMKZXYIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOS/c1-14-8-7-12-11(13)9-10-5-3-2-4-6-10/h10H,2-9H2,1H3,(H,12,13).
What are the key properties of 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide?
2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide has a molecular weight of 215.36 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(2-methylsulfanylethyl)acetamide is sourced from PubChem (CID 18360983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).