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

C12H18N2O2S — CID 55230484

IUPACN-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide
SMILESCC(N)CNS(=O)(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C12H18N2O2S/c1-9(13)8-14-17(15,16)12-6-5-10-3-2-4-11(10)7-12/h5-7,9,14H,2-4,8,13H2,1H3
InChIKeyXOGVKOLYFNISHV-UHFFFAOYSA-N
MW254.35 g/mol
LogP0.80
Rot. Bonds4

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

N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide (PubChem CID 55230484) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide.

Molecular Properties

Compound NameN-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide
PubChem CID55230484
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide
SMILESCC(N)CNS(=O)(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C12H18N2O2S/c1-9(13)8-14-17(15,16)12-6-5-10-3-2-4-11(10)7-12/h5-7,9,14H,2-4,8,13H2,1H3
InChIKeyXOGVKOLYFNISHV-UHFFFAOYSA-N
XLogP0.80
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenylpropyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 43001353
N-(2-bromo-4-methylpentyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 107158218
N-ethyl-2,3-dihydro-1H-indene-5-sulfonamide
CID 43212855
3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)-2-hydroxypropanamide
CID 107258346
2-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoic acid
CID 62676412
methyl 2-bromo-3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)propanoate
CID 103493750
methyl 2-chloro-3-(2,3-dihydro-1H-inden-5-ylsulfonylamino)propanoate
CID 103493556
N-(2-chloro-3-methoxypropyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 65031254
N-[(2S)-2-morpholin-4-ylpropyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 51873210
N-(4-chloropentyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 106135464
N-(2-methylpropyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide
CID 112990740
N-[(2R)-2-aminopropyl]-3-bromo-4-methylbenzenesulfonamide
CID 124628497

Frequently Asked Questions

What is the IUPAC name of N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide?
The IUPAC name of N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide (CID 55230484) is N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide.
What is the SMILES notation for N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide?
The canonical SMILES for N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide is CC(N)CNS(=O)(=O)c1ccc2c(c1)CCC2.
What is the InChIKey of N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide?
The InChIKey is XOGVKOLYFNISHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-9(13)8-14-17(15,16)12-6-5-10-3-2-4-11(10)7-12/h5-7,9,14H,2-4,8,13H2,1H3.
What are the key properties of N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide?
N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide has a molecular weight of 254.35 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminopropyl)-2,3-dihydro-1H-indene-5-sulfonamide is sourced from PubChem (CID 55230484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).