N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide

C16H21NO4S — CID 10639657

IUPACN-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1cc2c(cc1OC1CCCCC1)C(=O)CC2
InChIInChI=1S/C16H21NO4S/c1-22(19,20)17-14-9-11-7-8-15(18)13(11)10-16(14)21-12-5-3-2-4-6-12/h9-10,12,17H,2-8H2,1H3
InChIKeyWMOXGDVEJALKKH-UHFFFAOYSA-N
MW323.41 g/mol
LogP2.90
Rot. Bonds4

About N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide

N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide (PubChem CID 10639657) has the molecular formula C16H21NO4S and a molecular weight of 323.41 g/mol. Its IUPAC name is N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide
PubChem CID10639657
Molecular FormulaC16H21NO4S
Molecular Weight323.41 g/mol
Exact Mass323.12
IUPAC NameN-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1cc2c(cc1OC1CCCCC1)C(=O)CC2
InChIInChI=1S/C16H21NO4S/c1-22(19,20)17-14-9-11-7-8-15(18)13(11)10-16(14)21-12-5-3-2-4-6-12/h9-10,12,17H,2-8H2,1H3
InChIKeyWMOXGDVEJALKKH-UHFFFAOYSA-N
XLogP2.90
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.41
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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-Cyclopentyloxy-1-oxo-indan-5-yl)-methanesulfonamide
CID 10662676
3,7-Diamino-2-methoxyfluoren-9-one
CID 277054
1-(4-Amino-3-cyclohexyloxyphenyl)ethanone
CID 57381779
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-phenoxyindan-5-yl)methanesulfonamide
CID 3018586
N-[6-(4-Methanesulfonyl-phenoxy)-1-oxo-indan-5-yl]-methanesulfonamide
CID 10763244

Frequently Asked Questions

What is the IUPAC name of N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide?
The IUPAC name of N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide (CID 10639657) is N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide.
What is the SMILES notation for N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide?
The canonical SMILES for N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide is CS(=O)(=O)Nc1cc2c(cc1OC1CCCCC1)C(=O)CC2.
What is the InChIKey of N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide?
The InChIKey is WMOXGDVEJALKKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO4S/c1-22(19,20)17-14-9-11-7-8-15(18)13(11)10-16(14)21-12-5-3-2-4-6-12/h9-10,12,17H,2-8H2,1H3.
What are the key properties of N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide?
N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide has a molecular weight of 323.41 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-cyclohexyloxy-1-oxo-2,3-dihydroinden-5-yl)methanesulfonamide is sourced from PubChem (CID 10639657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).