N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide

C15H19NO5S — CID 15192150

IUPACN-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide
SMILESCS(=O)(=O)Nc1cc2c(cc1OC1CCOCC1)C(=O)CC2
InChIInChI=1S/C15H19NO5S/c1-22(18,19)16-13-8-10-2-3-14(17)12(10)9-15(13)21-11-4-6-20-7-5-11/h8-9,11,16H,2-7H2,1H3
InChIKeyUMLFTPSNVFTJRW-UHFFFAOYSA-N
MW325.39 g/mol
LogP1.74
Rot. Bonds4

About N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide

N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide (PubChem CID 15192150) has the molecular formula C15H19NO5S and a molecular weight of 325.39 g/mol. Its IUPAC name is N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide
PubChem CID15192150
Molecular FormulaC15H19NO5S
Molecular Weight325.39 g/mol
Exact Mass325.10
IUPAC NameN-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide
SMILESCS(=O)(=O)Nc1cc2c(cc1OC1CCOCC1)C(=O)CC2
InChIInChI=1S/C15H19NO5S/c1-22(18,19)16-13-8-10-2-3-14(17)12(10)9-15(13)21-11-4-6-20-7-5-11/h8-9,11,16H,2-7H2,1H3
InChIKeyUMLFTPSNVFTJRW-UHFFFAOYSA-N
XLogP1.74
TPSA81.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Flosulide
CID 71246
FK 3311
CID 164009
N-[6-(4-Methylsulfanyl-phenoxy)-1-oxo-indan-5-yl]-methanesulfonamide
CID 10570709
N-(6-Cyclohexyloxy-1-oxo-indan-5-yl)-methanesulfonamide
CID 10639657
N-(6-Cyclopentyloxy-1-oxo-indan-5-yl)-methanesulfonamide
CID 10662676
3,7-Diamino-2-methoxyfluoren-9-one
CID 277054
N-(4-acetyl-2-butoxyphenyl)methanesulfonamide
CID 57381780
N-(4-acetyl-2-pentoxyphenyl)methanesulfonamide
CID 57381998
N-(4-acetyl-2-hexoxyphenyl)methanesulfonamide
CID 57381999
N-(4-acetyl-2-cyclohexyloxyphenyl)methanesulfonamide
CID 57382000
N-[6-(4-Methanesulfonyl-phenoxy)-1-oxo-indan-5-yl]-methanesulfonamide
CID 10763244
N-(4-acetyl-2-ethoxyphenyl)methanesulfonamide
CID 71477044

Frequently Asked Questions

What is the IUPAC name of N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide?
The IUPAC name of N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide (CID 15192150) is N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide.
What is the SMILES notation for N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide?
The canonical SMILES for N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide is CS(=O)(=O)Nc1cc2c(cc1OC1CCOCC1)C(=O)CC2.
What is the InChIKey of N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide?
The InChIKey is UMLFTPSNVFTJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO5S/c1-22(18,19)16-13-8-10-2-3-14(17)12(10)9-15(13)21-11-4-6-20-7-5-11/h8-9,11,16H,2-7H2,1H3.
What are the key properties of N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide?
N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide has a molecular weight of 325.39 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(oxan-4-yloxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide is sourced from PubChem (CID 15192150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).