N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide

C16H17NO3S — CID 3018586

IUPACN-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1cc2c(cc1Oc1ccccc1)CCC2
InChIInChI=1S/C16H17NO3S/c1-21(18,19)17-15-10-12-6-5-7-13(12)11-16(15)20-14-8-3-2-4-9-14/h2-4,8-11,17H,5-7H2,1H3
InChIKeyHCBMEMPZHUPGHY-UHFFFAOYSA-N
MW303.38 g/mol
LogP3.34
Rot. Bonds4

About N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide

N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide (PubChem CID 3018586) has the molecular formula C16H17NO3S and a molecular weight of 303.38 g/mol. Its IUPAC name is N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide
PubChem CID3018586
Molecular FormulaC16H17NO3S
Molecular Weight303.38 g/mol
Exact Mass303.09
IUPAC NameN-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1cc2c(cc1Oc1ccccc1)CCC2
InChIInChI=1S/C16H17NO3S/c1-21(18,19)17-15-10-12-6-5-7-13(12)11-16(15)20-14-8-3-2-4-9-14/h2-4,8-11,17H,5-7H2,1H3
InChIKeyHCBMEMPZHUPGHY-UHFFFAOYSA-N
XLogP3.34
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.38
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Flosulide
CID 71246
3,7-Diamino-2-methoxyfluorene
CID 276255
N-[4-[4-(ethylsulfonylamino)-3-methoxyphenyl]-2-methoxyphenyl]ethanesulfonamide
CID 1293958
N-(2,2,4-trimethyl-2,3-dihydro-1-benzofuran-7-yl)benzenesulfonamide
CID 3767572
N-(6-Cyclohexyloxy-1-oxo-indan-5-yl)-methanesulfonamide
CID 10639657
7-Methoxy-9h-fluoren-2-amine
CID 247042
3-methyl-N-(2,2,4-trimethyl-2,3-dihydro-1-benzofuran-7-yl)benzenesulfonamide
CID 5134374
N-(2-Methyl-4'-phenoxy[1,1'-biphenyl]-4-yl)methanesulfonamide
CID 59313651
Fluoren-2-amine, 1-methoxy-
CID 23326
N,N'-[methylenebis(6-methoxy-3,1-phenylene)]dimethanesulfonamide
CID 30449102
Fluoren-2-amine, 3-methoxy-
CID 44145407
N-(6-(2,4-difluorophenoxy)indan-5-yl)methanesulfonamide
CID 133731

Frequently Asked Questions

What is the IUPAC name of N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide?
The IUPAC name of N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide (CID 3018586) is N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide.
What is the SMILES notation for N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide?
The canonical SMILES for N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide is CS(=O)(=O)Nc1cc2c(cc1Oc1ccccc1)CCC2.
What is the InChIKey of N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide?
The InChIKey is HCBMEMPZHUPGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3S/c1-21(18,19)17-15-10-12-6-5-7-13(12)11-16(15)20-14-8-3-2-4-9-14/h2-4,8-11,17H,5-7H2,1H3.
What are the key properties of N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide?
N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide has a molecular weight of 303.38 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide is sourced from PubChem (CID 3018586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).