N-cyclopropylhexane-1-sulfonamide

C9H19NO2S — CID 67119181

IUPACN-cyclopropylhexane-1-sulfonamide
SMILESCCCCCCS(=O)(=O)NC1CC1
InChIInChI=1S/C9H19NO2S/c1-2-3-4-5-8-13(11,12)10-9-6-7-9/h9-10H,2-8H2,1H3
InChIKeyDAHWIGOHCXKXJB-UHFFFAOYSA-N
MW205.32 g/mol
LogP1.65
Rot. Bonds7

About N-cyclopropylhexane-1-sulfonamide

N-cyclopropylhexane-1-sulfonamide (PubChem CID 67119181) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is N-cyclopropylhexane-1-sulfonamide.

Molecular Properties

Compound NameN-cyclopropylhexane-1-sulfonamide
PubChem CID67119181
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC NameN-cyclopropylhexane-1-sulfonamide
SMILESCCCCCCS(=O)(=O)NC1CC1
InChIInChI=1S/C9H19NO2S/c1-2-3-4-5-8-13(11,12)10-9-6-7-9/h9-10H,2-8H2,1H3
InChIKeyDAHWIGOHCXKXJB-UHFFFAOYSA-N
XLogP1.65
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 51.65
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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Related Compounds

6-bromo-N-cyclopropylhexane-1-sulfonamide
CID 22111560
N-(2,2,6,6-tetramethylpiperidin-4-yl)dodecane-1-sulfonamide
CID 20789888
N-(3-aminocyclobutyl)butane-1-sulfonamide
CID 43597856
N-[3-(methylamino)cyclobutyl]butane-1-sulfonamide
CID 178076415
6-chloro-N-cyclopentylhexane-1-sulfonamide
CID 22111628
N-[4-(aminomethyl)cyclohexyl]propane-1-sulfonamide
CID 68898541
3-hydroxy-N-(4-propylcyclohexyl)propane-1-sulfonamide
CID 114134664
N-(1-propan-2-ylpiperidin-4-yl)butane-1-sulfonamide
CID 22772688
6-chloro-N-cyclohexylhexane-1-sulfonamide
CID 22111516
N-[4-(4,6-dimethylpyrimidin-2-yl)oxycyclohexyl]butane-1-sulfonamide
CID 90635022
N-(3-methoxycyclopentyl)-4-(propylamino)butane-1-sulfonamide
CID 106093077
N-[2-methyl-4-[[3-methyl-4-(octylsulfonylamino)cyclohexyl]methyl]cyclohexyl]octane-1-sulfonamide
CID 20789898

Frequently Asked Questions

What is the IUPAC name of N-cyclopropylhexane-1-sulfonamide?
The IUPAC name of N-cyclopropylhexane-1-sulfonamide (CID 67119181) is N-cyclopropylhexane-1-sulfonamide.
What is the SMILES notation for N-cyclopropylhexane-1-sulfonamide?
The canonical SMILES for N-cyclopropylhexane-1-sulfonamide is CCCCCCS(=O)(=O)NC1CC1.
What is the InChIKey of N-cyclopropylhexane-1-sulfonamide?
The InChIKey is DAHWIGOHCXKXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-2-3-4-5-8-13(11,12)10-9-6-7-9/h9-10H,2-8H2,1H3.
What are the key properties of N-cyclopropylhexane-1-sulfonamide?
N-cyclopropylhexane-1-sulfonamide has a molecular weight of 205.32 g/mol, XLogP of 1.65, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropylhexane-1-sulfonamide is sourced from PubChem (CID 67119181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).