2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide

C15H25N3O2S — CID 62152910

IUPAC2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
SMILESCNc1ccccc1S(=O)(=O)NCC(C)N1CCCCC1
InChIInChI=1S/C15H25N3O2S/c1-13(18-10-6-3-7-11-18)12-17-21(19,20)15-9-5-4-8-14(15)16-2/h4-5,8-9,13,16-17H,3,6-7,10-12H2,1-2H3
InChIKeyMORYGSHEPBWTSV-UHFFFAOYSA-N
MW311.45 g/mol
LogP1.88
Rot. Bonds6

About 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide

2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide (PubChem CID 62152910) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
PubChem CID62152910
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
SMILESCNc1ccccc1S(=O)(=O)NCC(C)N1CCCCC1
InChIInChI=1S/C15H25N3O2S/c1-13(18-10-6-3-7-11-18)12-17-21(19,20)15-9-5-4-8-14(15)16-2/h4-5,8-9,13,16-17H,3,6-7,10-12H2,1-2H3
InChIKeyMORYGSHEPBWTSV-UHFFFAOYSA-N
XLogP1.88
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide 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

2-chloro-N-[2-(4-methylpiperidin-1-yl)propyl]benzenesulfonamide
CID 112502530
4-bromo-2-fluoro-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
CID 116528435
2-bromo-N-(2-morpholin-4-ylpropyl)benzenesulfonamide
CID 43064542
2-(methylamino)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzenesulfonamide
CID 62158541
5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide
CID 106015870
N-(2-piperidin-1-ylpropyl)-4-propan-2-yloxybenzenesulfonamide
CID 112502420
1-(2-aminophenyl)-N-(2-piperidin-1-ylpropyl)methanesulfonamide
CID 62021095
3-cyano-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
CID 61060484
3-amino-N-(2-piperidin-1-ylpropyl)pyridine-2-sulfonamide
CID 103305481
1-[1-(sulfamoylamino)propan-2-yl]piperidine
CID 112686143
1-chloro-N-(2-piperidin-1-ylpropyl)methanesulfonamide
CID 63663943
N-[2-(azocan-1-yl)propyl]aniline
CID 62558695

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide?
The IUPAC name of 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide (CID 62152910) is 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide.
What is the SMILES notation for 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide?
The canonical SMILES for 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide is CNc1ccccc1S(=O)(=O)NCC(C)N1CCCCC1.
What is the InChIKey of 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide?
The InChIKey is MORYGSHEPBWTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-13(18-10-6-3-7-11-18)12-17-21(19,20)15-9-5-4-8-14(15)16-2/h4-5,8-9,13,16-17H,3,6-7,10-12H2,1-2H3.
What are the key properties of 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide?
2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide has a molecular weight of 311.45 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide is sourced from PubChem (CID 62152910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).