2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide

C14H20N2O2S — CID 106087839

IUPAC2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide
SMILESO=S(=O)(CCNC1CC1)NC1Cc2ccccc2C1
InChIInChI=1S/C14H20N2O2S/c17-19(18,8-7-15-13-5-6-13)16-14-9-11-3-1-2-4-12(11)10-14/h1-4,13-16H,5-10H2
InChIKeyYDJJCJULTRPISM-UHFFFAOYSA-N
MW280.39 g/mol
LogP0.83
Rot. Bonds6

About 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide

2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide (PubChem CID 106087839) has the molecular formula C14H20N2O2S and a molecular weight of 280.39 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide
PubChem CID106087839
Molecular FormulaC14H20N2O2S
Molecular Weight280.39 g/mol
Exact Mass280.12
IUPAC Name2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide
SMILESO=S(=O)(CCNC1CC1)NC1Cc2ccccc2C1
InChIInChI=1S/C14H20N2O2S/c17-19(18,8-7-15-13-5-6-13)16-14-9-11-3-1-2-4-12(11)10-14/h1-4,13-16H,5-10H2
InChIKeyYDJJCJULTRPISM-UHFFFAOYSA-N
XLogP0.83
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide?
The IUPAC name of 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide (CID 106087839) is 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide?
The canonical SMILES for 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide is O=S(=O)(CCNC1CC1)NC1Cc2ccccc2C1.
What is the InChIKey of 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide?
The InChIKey is YDJJCJULTRPISM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2S/c17-19(18,8-7-15-13-5-6-13)16-14-9-11-3-1-2-4-12(11)10-14/h1-4,13-16H,5-10H2.
What are the key properties of 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide?
2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide has a molecular weight of 280.39 g/mol, XLogP of 0.83, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide is sourced from PubChem (CID 106087839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).