N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide

C15H24N2O2S — CID 107366552

IUPACN-(3-aminopropyl)-N-benzylcyclopentanesulfonamide
SMILESNCCCN(Cc1ccccc1)S(=O)(=O)C1CCCC1
InChIInChI=1S/C15H24N2O2S/c16-11-6-12-17(13-14-7-2-1-3-8-14)20(18,19)15-9-4-5-10-15/h1-3,7-8,15H,4-6,9-13,16H2
InChIKeyLVOGLVPMFVHRCA-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.11
Rot. Bonds7

About N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide

N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide (PubChem CID 107366552) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-benzylcyclopentanesulfonamide
PubChem CID107366552
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC NameN-(3-aminopropyl)-N-benzylcyclopentanesulfonamide
SMILESNCCCN(Cc1ccccc1)S(=O)(=O)C1CCCC1
InChIInChI=1S/C15H24N2O2S/c16-11-6-12-17(13-14-7-2-1-3-8-14)20(18,19)15-9-4-5-10-15/h1-3,7-8,15H,4-6,9-13,16H2
InChIKeyLVOGLVPMFVHRCA-UHFFFAOYSA-N
XLogP2.11
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dibenzylcyclohexanesulfonamide
CID 162418871
N-(3-aminopropyl)-N-benzyl-1,1-difluoromethanesulfonamide
CID 107366466
N-(3-aminopropyl)-N-benzylpiperidine-1-sulfonamide
CID 107366720
N-(2-aminoethyl)-N-benzyl-1,1-dioxothiolane-3-sulfonamide
CID 106511503
N-(3-aminopropyl)-N-benzyl-2,6-difluorobenzenesulfonamide
CID 120664086
N-(2-aminoethyl)-N-benzyl-1-cyclohexylmethanesulfonamide;hydrochloride
CID 120584146
N-(3-aminopropyl)-N-benzyl-2-bromobenzenesulfonamide;hydrochloride
CID 120664411
N-(3-aminopropyl)-N-cyclopentyl-1-phenylmethanesulfonamide
CID 43319471
N-(3-aminopropyl)-N-benzyl-2-methoxyethanesulfonamide;hydrochloride
CID 120664287
2-[(4-aminophenyl)methyl-cyclopentylsulfonylamino]acetamide
CID 105360561
N-(3-aminopropyl)-N-ethylcyclopropanesulfonamide
CID 64554481
N-(2-aminoethyl)-N-benzyl-4-methoxyoxolane-3-sulfonamide
CID 167986682

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide?
The IUPAC name of N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide (CID 107366552) is N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide.
What is the SMILES notation for N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide?
The canonical SMILES for N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide is NCCCN(Cc1ccccc1)S(=O)(=O)C1CCCC1.
What is the InChIKey of N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide?
The InChIKey is LVOGLVPMFVHRCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c16-11-6-12-17(13-14-7-2-1-3-8-14)20(18,19)15-9-4-5-10-15/h1-3,7-8,15H,4-6,9-13,16H2.
What are the key properties of N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide?
N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide has a molecular weight of 296.44 g/mol, XLogP of 2.11, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide is sourced from PubChem (CID 107366552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).