N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide

C19H14N2O2S — CID 8834385

IUPACN-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide
SMILESN#Cc1ccccc1NS(=O)(=O)c1ccc2cccc3c2c1CC3
InChIInChI=1S/C19H14N2O2S/c20-12-15-4-1-2-7-17(15)21-24(22,23)18-11-9-14-6-3-5-13-8-10-16(18)19(13)14/h1-7,9,11,21H,8,10H2
InChIKeyHWBVWQQVWJOQAN-UHFFFAOYSA-N
MW334.40 g/mol
LogP3.61
Rot. Bonds3

About N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide

N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide (PubChem CID 8834385) has the molecular formula C19H14N2O2S and a molecular weight of 334.40 g/mol. Its IUPAC name is N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide
PubChem CID8834385
Molecular FormulaC19H14N2O2S
Molecular Weight334.40 g/mol
Exact Mass334.08
IUPAC NameN-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide
SMILESN#Cc1ccccc1NS(=O)(=O)c1ccc2cccc3c2c1CC3
InChIInChI=1S/C19H14N2O2S/c20-12-15-4-1-2-7-17(15)21-24(22,23)18-11-9-14-6-3-5-13-8-10-16(18)19(13)14/h1-7,9,11,21H,8,10H2
InChIKeyHWBVWQQVWJOQAN-UHFFFAOYSA-N
XLogP3.61
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-naphthalen-1-yl-8,9-dihydro-7H-phenalene-1-sulfonamide
CID 21210486
potassium 1,2-dihydroacenaphthylene-3-sulfonate
CID 146050724
N-(2-cyanophenyl)benzenesulfonamide
CID 736007
2-amino-4-chloro-N-(2-cyanophenyl)benzenesulfonamide
CID 28542938
2-cyano-N-(2-cyanophenyl)pyridine-3-sulfonamide
CID 106595115
2-cyano-N-(2-phenylphenyl)benzenesulfonamide
CID 26979564
2-cyano-N-(2-phenoxyphenyl)benzenesulfonamide
CID 26980043
5-bromo-N-(2-cyanophenyl)-2-methylbenzenesulfonamide
CID 8513690
N-(2-cyanophenyl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 54930145
5-amino-2-bromo-N-(2-cyanophenyl)benzenesulfonamide
CID 65201755
N-(2-cyanophenyl)-4,5-dimethoxy-2-methylbenzenesulfonamide
CID 110758865
N-(2-cyanophenyl)-2-(ethylamino)pyridine-3-sulfonamide
CID 62143298

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide?
The IUPAC name of N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide (CID 8834385) is N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide.
What is the SMILES notation for N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide?
The canonical SMILES for N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide is N#Cc1ccccc1NS(=O)(=O)c1ccc2cccc3c2c1CC3.
What is the InChIKey of N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide?
The InChIKey is HWBVWQQVWJOQAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2S/c20-12-15-4-1-2-7-17(15)21-24(22,23)18-11-9-14-6-3-5-13-8-10-16(18)19(13)14/h1-7,9,11,21H,8,10H2.
What are the key properties of N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide?
N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide has a molecular weight of 334.40 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-1,2-dihydroacenaphthylene-3-sulfonamide is sourced from PubChem (CID 8834385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).