N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide

C14H16N2O3S — CID 138018171

IUPACN-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide
SMILESCc1ncoc1CNS(=O)(=O)C1Cc2ccccc2C1
InChIInChI=1S/C14H16N2O3S/c1-10-14(19-9-15-10)8-16-20(17,18)13-6-11-4-2-3-5-12(11)7-13/h2-5,9,13,16H,6-8H2,1H3
InChIKeyISPXJGQPBHMZQO-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.57
Rot. Bonds4

About N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide

N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide (PubChem CID 138018171) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide.

Molecular Properties

Compound NameN-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide
PubChem CID138018171
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC NameN-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide
SMILESCc1ncoc1CNS(=O)(=O)C1Cc2ccccc2C1
InChIInChI=1S/C14H16N2O3S/c1-10-14(19-9-15-10)8-16-20(17,18)13-6-11-4-2-3-5-12(11)7-13/h2-5,9,13,16H,6-8H2,1H3
InChIKeyISPXJGQPBHMZQO-UHFFFAOYSA-N
XLogP1.57
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide?
The IUPAC name of N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide (CID 138018171) is N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide.
What is the SMILES notation for N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide?
The canonical SMILES for N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide is Cc1ncoc1CNS(=O)(=O)C1Cc2ccccc2C1.
What is the InChIKey of N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide?
The InChIKey is ISPXJGQPBHMZQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-10-14(19-9-15-10)8-16-20(17,18)13-6-11-4-2-3-5-12(11)7-13/h2-5,9,13,16H,6-8H2,1H3.
What are the key properties of N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide?
N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide has a molecular weight of 292.36 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-1,3-oxazol-5-yl)methyl]-2,3-dihydro-1H-indene-2-sulfonamide is sourced from PubChem (CID 138018171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).