N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide

C14H28N2O2S — CID 59537369

IUPACN-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide
SMILESNC1CCCCC1NS(=O)(=O)CC1CCCCCC1
InChIInChI=1S/C14H28N2O2S/c15-13-9-5-6-10-14(13)16-19(17,18)11-12-7-3-1-2-4-8-12/h12-14,16H,1-11,15H2
InChIKeyUJOOIAGJAKPBFZ-UHFFFAOYSA-N
MW288.46 g/mol
LogP2.15
Rot. Bonds4

About N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide

N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide (PubChem CID 59537369) has the molecular formula C14H28N2O2S and a molecular weight of 288.46 g/mol. Its IUPAC name is N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide
PubChem CID59537369
Molecular FormulaC14H28N2O2S
Molecular Weight288.46 g/mol
Exact Mass288.19
IUPAC NameN-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide
SMILESNC1CCCCC1NS(=O)(=O)CC1CCCCCC1
InChIInChI=1S/C14H28N2O2S/c15-13-9-5-6-10-14(13)16-19(17,18)11-12-7-3-1-2-4-8-12/h12-14,16H,1-11,15H2
InChIKeyUJOOIAGJAKPBFZ-UHFFFAOYSA-N
XLogP2.15
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-1-cyclohexylmethanesulfonamide
CID 62955693
N-(2-bromocyclohexyl)-1-cyclohexylmethanesulfonamide
CID 114297347
1-cyclohexyl-N-[2-(hydroxymethyl)cyclopentyl]methanesulfonamide
CID 103697794
N-[(1R,2R)-2-aminocyclohexyl]propane-1-sulfonamide
CID 93452968
N-(2-aminocycloheptyl)butane-1-sulfonamide
CID 63258980
N-[(2-aminocyclohexyl)methyl]-1-cyclohexylmethanesulfonamide
CID 64929835
3-[(2-aminocycloheptyl)sulfamoyl]propanoic acid
CID 63258358
N-(2-aminocycloheptyl)-2-methoxyethanesulfonamide
CID 63258881
1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide
CID 104953228
N-(2-aminocyclohexyl)-4,4,4-trifluorobutane-1-sulfonamide
CID 83059853
N-(2-aminocyclopentyl)-3-methylbutane-1-sulfonamide
CID 63857525
N-(2-aminocyclohexyl)-1,1,1-trichloromethanesulfonamide
CID 18350596

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide?
The IUPAC name of N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide (CID 59537369) is N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide.
What is the SMILES notation for N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide?
The canonical SMILES for N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide is NC1CCCCC1NS(=O)(=O)CC1CCCCCC1.
What is the InChIKey of N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide?
The InChIKey is UJOOIAGJAKPBFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2S/c15-13-9-5-6-10-14(13)16-19(17,18)11-12-7-3-1-2-4-8-12/h12-14,16H,1-11,15H2.
What are the key properties of N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide?
N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide has a molecular weight of 288.46 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide is sourced from PubChem (CID 59537369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).