cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane

C9H21NOS — CID 167494200

IUPACcyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane
SMILESCC.CN=S(C)(=O)C1CCCC1
InChIInChI=1S/C7H15NOS.C2H6/c1-8-10(2,9)7-5-3-4-6-7;1-2/h7H,3-6H2,1-2H3;1-2H3
InChIKeyHYTVLTZMMCYBHE-UHFFFAOYSA-N
MW191.34 g/mol
LogP2.68
Rot. Bonds1

About cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane

cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane (PubChem CID 167494200) has the molecular formula C9H21NOS and a molecular weight of 191.34 g/mol. Its IUPAC name is cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane.

Molecular Properties

Compound Namecyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane
PubChem CID167494200
Molecular FormulaC9H21NOS
Molecular Weight191.34 g/mol
Exact Mass191.13
IUPAC Namecyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane
SMILESCC.CN=S(C)(=O)C1CCCC1
InChIInChI=1S/C7H15NOS.C2H6/c1-8-10(2,9)7-5-3-4-6-7;1-2/h7H,3-6H2,1-2H3;1-2H3
InChIKeyHYTVLTZMMCYBHE-UHFFFAOYSA-N
XLogP2.68
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.34
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane 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

cyclohexyl-methyl-methylimino-oxo-λ6-sulfane
CID 132969713
CID 174013761
CID 174013761
cyclobutyl-imino-methyl-oxo-λ6-sulfane
CID 167262038
2-cycloheptylsulfonylpropanoic acid
CID 82925993
propan-2-yl cyclopentanesulfonate
CID 22436828
(2R)-2-cyclohexylsulfonyl-3-methylbutanoic acid
CID 51889995
2-cyclopentylsulfonyl-N-methylpropan-1-amine
CID 106512846
(2S)-2-cyclohexylsulfonyl-3-methylbutanoic acid
CID 51889993
2-cyclohexylsulfonyl-3-methylbutanenitrile
CID 117037819
N-methylcyclopentanesulfonamide
CID 4105675
cyclopentanesulfonic acid
CID 15707015
2-amino-1-(3-methylsulfonylcyclohexyl)propan-1-one
CID 116551695

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane?
The IUPAC name of cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane (CID 167494200) is cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane.
What is the SMILES notation for cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane?
The canonical SMILES for cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane is CC.CN=S(C)(=O)C1CCCC1.
What is the InChIKey of cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane?
The InChIKey is HYTVLTZMMCYBHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NOS.C2H6/c1-8-10(2,9)7-5-3-4-6-7;1-2/h7H,3-6H2,1-2H3;1-2H3.
What are the key properties of cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane?
cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane has a molecular weight of 191.34 g/mol, XLogP of 2.68, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-methyl-methylimino-oxo-λ6-sulfane;ethane is sourced from PubChem (CID 167494200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).