N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide

C14H22N2O2S — CID 43541535

IUPACN-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide
SMILESCCN(C1CCCC1)S(=O)(=O)c1ccc(NC)cc1
InChIInChI=1S/C14H22N2O2S/c1-3-16(13-6-4-5-7-13)19(17,18)14-10-8-12(15-2)9-11-14/h8-11,13,15H,3-7H2,1-2H3
InChIKeyFJFGHDAAHDSJQM-UHFFFAOYSA-N
MW282.41 g/mol
LogP2.68
Rot. Bonds5

About N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide

N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide (PubChem CID 43541535) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide
PubChem CID43541535
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide
SMILESCCN(C1CCCC1)S(=O)(=O)c1ccc(NC)cc1
InChIInChI=1S/C14H22N2O2S/c1-3-16(13-6-4-5-7-13)19(17,18)14-10-8-12(15-2)9-11-14/h8-11,13,15H,3-7H2,1-2H3
InChIKeyFJFGHDAAHDSJQM-UHFFFAOYSA-N
XLogP2.68
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-ethyl-4-(methylamino)benzenesulfonamide
CID 43264442
N-cyclopentyl-N-ethyl-4-ethylsulfonylbenzenesulfonamide
CID 87024719
N-cyclopropyl-N-ethyl-4-(ethylamino)benzenesulfonamide
CID 62143418
4-acetyl-N-cyclopentyl-N-ethylbenzenesulfonamide
CID 43541526
N-cyclohexyl-N-ethyl-4-nitrobenzenesulfonamide
CID 3319709
4-(2-chloroethyl)-N-cyclopentyl-N-ethylbenzenesulfonamide
CID 43662724
4-[cyclohexyl(ethyl)sulfamoyl]benzenecarbothioamide
CID 43107449
4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide
CID 24679124
3-amino-4-chloro-N-cyclohexyl-N-ethylbenzenesulfonamide
CID 43096949
4-(aminomethyl)-N-cyclohexyl-N-ethyl-3-methylbenzenesulfonamide
CID 106919020
3-amino-N-cyclopentyl-N-ethyl-4-methoxybenzenesulfonamide
CID 43540778
3-(aminomethyl)-N-cyclopentyl-N-ethyl-4-fluorobenzenesulfonamide
CID 63287839

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide?
The IUPAC name of N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide (CID 43541535) is N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide is CCN(C1CCCC1)S(=O)(=O)c1ccc(NC)cc1.
What is the InChIKey of N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide?
The InChIKey is FJFGHDAAHDSJQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-3-16(13-6-4-5-7-13)19(17,18)14-10-8-12(15-2)9-11-14/h8-11,13,15H,3-7H2,1-2H3.
What are the key properties of N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide?
N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide has a molecular weight of 282.41 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide is sourced from PubChem (CID 43541535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).