N-(3-aminopropyl)-N-methylcyclohexanesulfonamide

C10H22N2O2S — CID 61065457

IUPACN-(3-aminopropyl)-N-methylcyclohexanesulfonamide
SMILESCN(CCCN)S(=O)(=O)C1CCCCC1
InChIInChI=1S/C10H22N2O2S/c1-12(9-5-8-11)15(13,14)10-6-3-2-4-7-10/h10H,2-9,11H2,1H3
InChIKeyLUXONOYVXAVCOI-UHFFFAOYSA-N
MW234.36 g/mol
LogP0.93
Rot. Bonds5

About N-(3-aminopropyl)-N-methylcyclohexanesulfonamide

N-(3-aminopropyl)-N-methylcyclohexanesulfonamide (PubChem CID 61065457) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-methylcyclohexanesulfonamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-methylcyclohexanesulfonamide
PubChem CID61065457
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC NameN-(3-aminopropyl)-N-methylcyclohexanesulfonamide
SMILESCN(CCCN)S(=O)(=O)C1CCCCC1
InChIInChI=1S/C10H22N2O2S/c1-12(9-5-8-11)15(13,14)10-6-3-2-4-7-10/h10H,2-9,11H2,1H3
InChIKeyLUXONOYVXAVCOI-UHFFFAOYSA-N
XLogP0.93
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-N-methylcyclopentanesulfonamide
CID 83701794
N'-[cyclopentylmethyl(methyl)sulfamoyl]-N'-methylpropane-1,3-diamine
CID 63630912
N-(3-bromopropyl)-N-methylcyclopropanesulfonamide
CID 106441788
3-[cyclopentylsulfonyl(methyl)amino]-N'-hydroxypropanimidamide
CID 105361578
N-(3-aminopropyl)-N-ethylcyclopropanesulfonamide
CID 64554481
N'-cycloheptyl-N'-(dimethylsulfamoyl)propane-1,3-diamine
CID 43137026
N-(3-aminopropyl)-2-(hydroxymethyl)-N-methylazepane-1-sulfonamide
CID 116634407
2-[[3-aminopropyl(methyl)sulfamoyl]amino]ethylcyclopentane
CID 54952302
N-(3-aminopropyl)-N-methylpiperidine-1-sulfonamide
CID 28783231
N-(2-aminoethyl)-N-propylcyclopentanesulfonamide
CID 105360476
N-(3-aminopropyl)-2-cycloheptyl-N-methylacetamide
CID 115737510
(4aR,8aR)-N-(3-aminopropyl)-N-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-sulfonamide
CID 102726076

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-methylcyclohexanesulfonamide?
The IUPAC name of N-(3-aminopropyl)-N-methylcyclohexanesulfonamide (CID 61065457) is N-(3-aminopropyl)-N-methylcyclohexanesulfonamide.
What is the SMILES notation for N-(3-aminopropyl)-N-methylcyclohexanesulfonamide?
The canonical SMILES for N-(3-aminopropyl)-N-methylcyclohexanesulfonamide is CN(CCCN)S(=O)(=O)C1CCCCC1.
What is the InChIKey of N-(3-aminopropyl)-N-methylcyclohexanesulfonamide?
The InChIKey is LUXONOYVXAVCOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-12(9-5-8-11)15(13,14)10-6-3-2-4-7-10/h10H,2-9,11H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-methylcyclohexanesulfonamide?
N-(3-aminopropyl)-N-methylcyclohexanesulfonamide has a molecular weight of 234.36 g/mol, XLogP of 0.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-methylcyclohexanesulfonamide is sourced from PubChem (CID 61065457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).