2-amino-N-(4-propylphenyl)ethanesulfonamide

C11H18N2O2S — CID 43378670

IUPAC2-amino-N-(4-propylphenyl)ethanesulfonamide
SMILESCCCc1ccc(NS(=O)(=O)CCN)cc1
InChIInChI=1S/C11H18N2O2S/c1-2-3-10-4-6-11(7-5-10)13-16(14,15)9-8-12/h4-7,13H,2-3,8-9,12H2,1H3
InChIKeyGAVGKUXIETURTK-UHFFFAOYSA-N
MW242.34 g/mol
LogP1.34
Rot. Bonds6

About 2-amino-N-(4-propylphenyl)ethanesulfonamide

2-amino-N-(4-propylphenyl)ethanesulfonamide (PubChem CID 43378670) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is 2-amino-N-(4-propylphenyl)ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-(4-propylphenyl)ethanesulfonamide
PubChem CID43378670
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC Name2-amino-N-(4-propylphenyl)ethanesulfonamide
SMILESCCCc1ccc(NS(=O)(=O)CCN)cc1
InChIInChI=1S/C11H18N2O2S/c1-2-3-10-4-6-11(7-5-10)13-16(14,15)9-8-12/h4-7,13H,2-3,8-9,12H2,1H3
InChIKeyGAVGKUXIETURTK-UHFFFAOYSA-N
XLogP1.34
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(4-butylphenyl)ethanesulfonamide
CID 43378477
N-[4-(aminomethyl)phenyl]propane-1-sulfonamide
CID 11002376
N-[4-(3-aminopropyl)phenyl]ethanesulfonamide
CID 28754709
3-chloro-N-(4-pentylphenyl)propane-1-sulfonamide
CID 61250073
N-[4-[(dimethylamino)methyl]phenyl]propane-1-sulfonamide
CID 64585715
N-[4-(4-amino-2-methylbutan-2-yl)phenyl]propane-1-sulfonamide
CID 79830757
4-chloro-N-(4-propylphenyl)benzenesulfonamide
CID 167013208
N-(4-ethylphenyl)-4-propylbenzenesulfonamide
CID 22773839
2-[4-(propylsulfonylamino)phenyl]acetic acid
CID 16786405
5-(aminomethyl)-2-methyl-N-(4-propylphenyl)thiophene-3-sulfonamide
CID 106026493
N-[4-(aminomethyl)phenyl]-3-methylbutane-1-sulfonamide
CID 63834583
N-(4-ethylphenyl)ethanesulfonamide
CID 896511

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-propylphenyl)ethanesulfonamide?
The IUPAC name of 2-amino-N-(4-propylphenyl)ethanesulfonamide (CID 43378670) is 2-amino-N-(4-propylphenyl)ethanesulfonamide.
What is the SMILES notation for 2-amino-N-(4-propylphenyl)ethanesulfonamide?
The canonical SMILES for 2-amino-N-(4-propylphenyl)ethanesulfonamide is CCCc1ccc(NS(=O)(=O)CCN)cc1.
What is the InChIKey of 2-amino-N-(4-propylphenyl)ethanesulfonamide?
The InChIKey is GAVGKUXIETURTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-2-3-10-4-6-11(7-5-10)13-16(14,15)9-8-12/h4-7,13H,2-3,8-9,12H2,1H3.
What are the key properties of 2-amino-N-(4-propylphenyl)ethanesulfonamide?
2-amino-N-(4-propylphenyl)ethanesulfonamide has a molecular weight of 242.34 g/mol, XLogP of 1.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-propylphenyl)ethanesulfonamide is sourced from PubChem (CID 43378670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).