N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide

C15H30N2O2S — CID 61065631

IUPACN-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide
SMILESNCC1(NS(=O)(=O)C2CCCCC2)CCCCCCC1
InChIInChI=1S/C15H30N2O2S/c16-13-15(11-7-2-1-3-8-12-15)17-20(18,19)14-9-5-4-6-10-14/h14,17H,1-13,16H2
InChIKeyZFRZUDIWVTVLSX-UHFFFAOYSA-N
MW302.48 g/mol
LogP2.68
Rot. Bonds4

About N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide

N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide (PubChem CID 61065631) has the molecular formula C15H30N2O2S and a molecular weight of 302.48 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide
PubChem CID61065631
Molecular FormulaC15H30N2O2S
Molecular Weight302.48 g/mol
Exact Mass302.20
IUPAC NameN-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide
SMILESNCC1(NS(=O)(=O)C2CCCCC2)CCCCCCC1
InChIInChI=1S/C15H30N2O2S/c16-13-15(11-7-2-1-3-8-12-15)17-20(18,19)14-9-5-4-6-10-14/h14,17H,1-13,16H2
InChIKeyZFRZUDIWVTVLSX-UHFFFAOYSA-N
XLogP2.68
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.48
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide 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

N-[4-(aminomethyl)-1-methylpiperidin-4-yl]cyclohexanesulfonamide
CID 61065630
N-[1-(chloromethyl)cyclohexyl]cyclopentanesulfonamide
CID 105361716
2-[1-(cyclohexylsulfonylamino)cyclopentyl]acetic acid
CID 64673131
N-[1-(aminomethyl)cyclooctyl]-1-cyclopropylmethanesulfonamide
CID 64989622
N-[1-(aminomethyl)-3-methylcyclohexyl]-1,1-dioxothiane-4-sulfonamide
CID 63765461
1-(aminomethyl)-N-(cyclopropylsulfamoyl)cyclopentan-1-amine
CID 114803346
1-(aminomethyl)-N-(methylsulfamoyl)cycloheptan-1-amine
CID 114803362
1-(cyclohexylsulfonylamino)cyclooctane-1-carbothioamide
CID 61123572
1-(cyclohexylsulfonylamino)cycloheptane-1-carboxylic acid
CID 61066003
N-[[1-(aminomethyl)cyclopropyl]methyl]cyclopentanesulfonamide
CID 105361881
1-(cyclohexylsulfonylamino)cyclopentane-1-carboxylic acid
CID 61065837
N-(1-cyanocycloheptyl)cyclopentanesulfonamide
CID 105361084

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide?
The IUPAC name of N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide (CID 61065631) is N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide?
The canonical SMILES for N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide is NCC1(NS(=O)(=O)C2CCCCC2)CCCCCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide?
The InChIKey is ZFRZUDIWVTVLSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2S/c16-13-15(11-7-2-1-3-8-12-15)17-20(18,19)14-9-5-4-6-10-14/h14,17H,1-13,16H2.
What are the key properties of N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide?
N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide has a molecular weight of 302.48 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclooctyl]cyclohexanesulfonamide is sourced from PubChem (CID 61065631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).