N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide

C13H18N2O2S — CID 64989288

IUPACN-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide
SMILESNC1Cc2ccccc2C1NS(=O)(=O)CC1CC1
InChIInChI=1S/C13H18N2O2S/c14-12-7-10-3-1-2-4-11(10)13(12)15-18(16,17)8-9-5-6-9/h1-4,9,12-13,15H,5-8,14H2
InChIKeyWPCQJHNOVJGALY-UHFFFAOYSA-N
MW266.37 g/mol
LogP0.94
Rot. Bonds4

About N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide

N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide (PubChem CID 64989288) has the molecular formula C13H18N2O2S and a molecular weight of 266.37 g/mol. Its IUPAC name is N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide
PubChem CID64989288
Molecular FormulaC13H18N2O2S
Molecular Weight266.37 g/mol
Exact Mass266.11
IUPAC NameN-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide
SMILESNC1Cc2ccccc2C1NS(=O)(=O)CC1CC1
InChIInChI=1S/C13H18N2O2S/c14-12-7-10-3-1-2-4-11(10)13(12)15-18(16,17)8-9-5-6-9/h1-4,9,12-13,15H,5-8,14H2
InChIKeyWPCQJHNOVJGALY-UHFFFAOYSA-N
XLogP0.94
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2,3-dihydro-1H-inden-1-yl)cyclopentanesulfonamide
CID 114985336
1-N-(methylsulfamoyl)-2,3-dihydro-1H-indene-1,2-diamine
CID 114812781
N-(2-amino-2,3-dihydro-1H-inden-1-yl)propane-2-sulfonamide
CID 63767365
N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1,1-difluoromethanesulfonamide
CID 63765445
2-amino-1-(diethylsulfamoylamino)-2,3-dihydro-1H-indene
CID 63765446
N-(2-amino-2,3-dihydro-1H-inden-1-yl)-2-cyclopropylacetamide
CID 63754177
N-(2-bromo-2,3-dihydro-1H-inden-1-yl)-1-(oxolan-2-yl)methanesulfonamide
CID 114297933
N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]propane-1-sulfonamide
CID 113240016
N-(2-amino-2,3-dihydro-1H-inden-1-yl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 63766590
N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methylpropane-1-sulfonamide
CID 103834195
N-(2-amino-2,3-dihydro-1H-inden-1-yl)oxane-4-carboxamide
CID 63755990
4-[[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]sulfamoyl]butanoic acid
CID 107216303

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide?
The IUPAC name of N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide (CID 64989288) is N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide.
What is the SMILES notation for N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide?
The canonical SMILES for N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide is NC1Cc2ccccc2C1NS(=O)(=O)CC1CC1.
What is the InChIKey of N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide?
The InChIKey is WPCQJHNOVJGALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2S/c14-12-7-10-3-1-2-4-11(10)13(12)15-18(16,17)8-9-5-6-9/h1-4,9,12-13,15H,5-8,14H2.
What are the key properties of N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide?
N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide has a molecular weight of 266.37 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2,3-dihydro-1H-inden-1-yl)-1-cyclopropylmethanesulfonamide is sourced from PubChem (CID 64989288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).