N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide

C12H18N2O2S — CID 61348924

IUPACN-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide
SMILESCN(CCN)S(=O)(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C12H18N2O2S/c1-14(8-7-13)17(15,16)12-6-5-10-3-2-4-11(10)9-12/h5-6,9H,2-4,7-8,13H2,1H3
InChIKeyJAMKRHAHLZLNKI-UHFFFAOYSA-N
MW254.35 g/mol
LogP0.75
Rot. Bonds4

About N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide

N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide (PubChem CID 61348924) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide
PubChem CID61348924
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide
SMILESCN(CCN)S(=O)(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C12H18N2O2S/c1-14(8-7-13)17(15,16)12-6-5-10-3-2-4-11(10)9-12/h5-6,9H,2-4,7-8,13H2,1H3
InChIKeyJAMKRHAHLZLNKI-UHFFFAOYSA-N
XLogP0.75
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-N-propan-2-yl-2,3-dihydro-1H-indene-5-sulfonamide
CID 61348755
N-methyl-N-[2-(methylamino)ethyl]-2,3-dihydro-1H-indene-5-sulfonamide;hydrochloride
CID 120718201
N-(2-aminoethyl)-N-methyl-2,3-dihydro-1-benzofuran-5-sulfonamide
CID 62688441
2-[2,3-dihydro-1H-inden-5-ylsulfonyl(methyl)amino]acetic acid
CID 43084240
N-(3-aminopropyl)-N-ethyl-2,3-dihydro-1H-indene-5-sulfonamide
CID 43136904
N-(3-amino-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydronaphthalene-2-sulfonamide;hydrochloride
CID 119991436
N-(2-aminoethyl)-N-benzyl-2,3-dihydro-1H-indene-5-sulfonamide
CID 120584317
N-methyl-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 79701884
N-methyl-N-(piperidin-3-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 106630837
N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 110716108
N-(2-aminoethyl)-N,4-dimethylbenzenesulfonamide
CID 10376490
N-ethyl-N-(2-hydroxyethyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 54878655

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide?
The IUPAC name of N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide (CID 61348924) is N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide.
What is the SMILES notation for N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide?
The canonical SMILES for N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide is CN(CCN)S(=O)(=O)c1ccc2c(c1)CCC2.
What is the InChIKey of N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide?
The InChIKey is JAMKRHAHLZLNKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-14(8-7-13)17(15,16)12-6-5-10-3-2-4-11(10)9-12/h5-6,9H,2-4,7-8,13H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide?
N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide has a molecular weight of 254.35 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-methyl-2,3-dihydro-1H-indene-5-sulfonamide is sourced from PubChem (CID 61348924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).