N-cyclohexyl-3-methylsulfanylpropanamide

C10H19NOS — CID 10845759

IUPACN-cyclohexyl-3-methylsulfanylpropanamide
SMILESCSCCC(=O)NC1CCCCC1
InChIInChI=1S/C10H19NOS/c1-13-8-7-10(12)11-9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,11,12)
InChIKeyVVPJUYMCOVDILQ-UHFFFAOYSA-N
MW201.33 g/mol
LogP2.19
Rot. Bonds4

About N-cyclohexyl-3-methylsulfanylpropanamide

N-cyclohexyl-3-methylsulfanylpropanamide (PubChem CID 10845759) has the molecular formula C10H19NOS and a molecular weight of 201.33 g/mol. Its IUPAC name is N-cyclohexyl-3-methylsulfanylpropanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-methylsulfanylpropanamide
PubChem CID10845759
Molecular FormulaC10H19NOS
Molecular Weight201.33 g/mol
Exact Mass201.12
IUPAC NameN-cyclohexyl-3-methylsulfanylpropanamide
SMILESCSCCC(=O)NC1CCCCC1
InChIInChI=1S/C10H19NOS/c1-13-8-7-10(12)11-9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,11,12)
InChIKeyVVPJUYMCOVDILQ-UHFFFAOYSA-N
XLogP2.19
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.33
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclohexanecarbamic acid, thio-, S-ethyl ester
CID 161751
(2R)-N-cyclohexyl-3-methylsulfanyl-2-(propanoylamino)propanamide
CID 145981024
(2R)-2-acetamido-N-cyclohexyl-3-methylsulfanylpropanamide
CID 145990859
Propanamide, N-[2-(hexylthio)ethyl]-
CID 113635
N-cyclohexyl-2-mercaptoacetamide
CID 15730054
Butyramide, N-cyclohexyl-2-ethyl-2-ethylthio-
CID 48200
N-cyclohexyl-2-(methylsulfonyl)acetamide
CID 2806038
[2-(Cyclopentylamino)-2-oxoethyl]-dimethylsulfanium bromide
CID 118713942
2-cyclohexylsulfanyl-N-cyclopentylacetamide
CID 2374980
N-Cyclohexyl-3-sulfanylpropanamide
CID 14618019
N-cyclohexyl-2-(trifluoromethylsulfanyl)acetamide
CID 45883954
N-[3-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanylpropyl]acetamide
CID 71864577

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-methylsulfanylpropanamide?
The IUPAC name of N-cyclohexyl-3-methylsulfanylpropanamide (CID 10845759) is N-cyclohexyl-3-methylsulfanylpropanamide.
What is the SMILES notation for N-cyclohexyl-3-methylsulfanylpropanamide?
The canonical SMILES for N-cyclohexyl-3-methylsulfanylpropanamide is CSCCC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-methylsulfanylpropanamide?
The InChIKey is VVPJUYMCOVDILQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NOS/c1-13-8-7-10(12)11-9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,11,12).
What are the key properties of N-cyclohexyl-3-methylsulfanylpropanamide?
N-cyclohexyl-3-methylsulfanylpropanamide has a molecular weight of 201.33 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-methylsulfanylpropanamide is sourced from PubChem (CID 10845759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).