N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide

C18H20N2O3S — CID 167954905

IUPACN-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(S(=O)(=O)NC2CCc3cc(C)ccc32)c1
InChIInChI=1S/C18H20N2O3S/c1-12-6-8-17-14(10-12)7-9-18(17)20-24(22,23)16-5-3-4-15(11-16)19-13(2)21/h3-6,8,10-11,18,20H,7,9H2,1-2H3,(H,19,21)
InChIKeyHBALJYQXVZZGFF-UHFFFAOYSA-N
MW344.44 g/mol
LogP2.92
Rot. Bonds4

About N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide

N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide (PubChem CID 167954905) has the molecular formula C18H20N2O3S and a molecular weight of 344.44 g/mol. Its IUPAC name is N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide
PubChem CID167954905
Molecular FormulaC18H20N2O3S
Molecular Weight344.44 g/mol
Exact Mass344.12
IUPAC NameN-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(S(=O)(=O)NC2CCc3cc(C)ccc32)c1
InChIInChI=1S/C18H20N2O3S/c1-12-6-8-17-14(10-12)7-9-18(17)20-24(22,23)16-5-3-4-15(11-16)19-13(2)21/h3-6,8,10-11,18,20H,7,9H2,1-2H3,(H,19,21)
InChIKeyHBALJYQXVZZGFF-UHFFFAOYSA-N
XLogP2.92
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-2,3-dihydro-1H-inden-1-yl)-3-methylbenzenesulfonamide
CID 79723505
4-methoxy-N-(5-methyl-2,3-dihydro-1H-inden-1-yl)benzenesulfonamide
CID 154859038
N-[3-(cyclohexylsulfamoyl)phenyl]acetamide
CID 47314930
3-acetyl-N-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)benzenesulfonamide
CID 110399780
N-[5-[(3,4-dimethoxyphenyl)sulfonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]acetamide
CID 54530988
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-4-methylbenzenesulfonamide
CID 79723350
N-[4-[[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]sulfamoyl]phenyl]acetamide
CID 95317507
N-(5-methyl-2,3-dihydro-1H-inden-1-yl)-1,3-thiazole-4-sulfonamide
CID 154865052
N-(5-methyl-2,3-dihydro-1H-inden-1-yl)thieno[3,2-b]pyridine-6-sulfonamide
CID 154872561
N-[4-[(6-methyl-3,4-dihydro-2H-chromen-4-yl)sulfamoyl]phenyl]acetamide
CID 108781692
N-[5-[(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)sulfamoyl]-2-methylphenyl]acetamide
CID 120722247
4-(2-methoxyethylsulfonyl)-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
CID 167659779

Frequently Asked Questions

What is the IUPAC name of N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide (CID 167954905) is N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1cccc(S(=O)(=O)NC2CCc3cc(C)ccc32)c1.
What is the InChIKey of N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is HBALJYQXVZZGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3S/c1-12-6-8-17-14(10-12)7-9-18(17)20-24(22,23)16-5-3-4-15(11-16)19-13(2)21/h3-6,8,10-11,18,20H,7,9H2,1-2H3,(H,19,21).
What are the key properties of N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide?
N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 344.44 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(5-methyl-2,3-dihydro-1H-inden-1-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 167954905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).