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

C15H16N2O2S — CID 17408071

IUPACN-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide
SMILESO=S(=O)(NCc1ccccn1)c1ccc2c(c1)CCC2
InChIInChI=1S/C15H16N2O2S/c18-20(19,17-11-14-6-1-2-9-16-14)15-8-7-12-4-3-5-13(12)10-15/h1-2,6-10,17H,3-5,11H2
InChIKeyDWGCMTDMHHKGAF-UHFFFAOYSA-N
MW288.37 g/mol
LogP2.05
Rot. Bonds4

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

N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide (PubChem CID 17408071) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide.

Molecular Properties

Compound NameN-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide
PubChem CID17408071
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC NameN-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide
SMILESO=S(=O)(NCc1ccccn1)c1ccc2c(c1)CCC2
InChIInChI=1S/C15H16N2O2S/c18-20(19,17-11-14-6-1-2-9-16-14)15-8-7-12-4-3-5-13(12)10-15/h1-2,6-10,17H,3-5,11H2
InChIKeyDWGCMTDMHHKGAF-UHFFFAOYSA-N
XLogP2.05
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide?
The IUPAC name of N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide (CID 17408071) is N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide.
What is the SMILES notation for N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide?
The canonical SMILES for N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide is O=S(=O)(NCc1ccccn1)c1ccc2c(c1)CCC2.
What is the InChIKey of N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide?
The InChIKey is DWGCMTDMHHKGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c18-20(19,17-11-14-6-1-2-9-16-14)15-8-7-12-4-3-5-13(12)10-15/h1-2,6-10,17H,3-5,11H2.
What are the key properties of N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide?
N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide has a molecular weight of 288.37 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-2-ylmethyl)-2,3-dihydro-1H-indene-5-sulfonamide is sourced from PubChem (CID 17408071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).