N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide

C19H18N2O3S — CID 154839133

IUPACN-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide
SMILESCc1ccc2ncccc2c1S(=O)(=O)Nc1cccc2c1OCCC2
InChIInChI=1S/C19H18N2O3S/c1-13-9-10-16-15(7-3-11-20-16)19(13)25(22,23)21-17-8-2-5-14-6-4-12-24-18(14)17/h2-3,5,7-11,21H,4,6,12H2,1H3
InChIKeyDNDHBSCLSYXZHF-UHFFFAOYSA-N
MW354.43 g/mol
LogP3.67
Rot. Bonds3

About N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide

N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide (PubChem CID 154839133) has the molecular formula C19H18N2O3S and a molecular weight of 354.43 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide
PubChem CID154839133
Molecular FormulaC19H18N2O3S
Molecular Weight354.43 g/mol
Exact Mass354.10
IUPAC NameN-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide
SMILESCc1ccc2ncccc2c1S(=O)(=O)Nc1cccc2c1OCCC2
InChIInChI=1S/C19H18N2O3S/c1-13-9-10-16-15(7-3-11-20-16)19(13)25(22,23)21-17-8-2-5-14-6-4-12-24-18(14)17/h2-3,5,7-11,21H,4,6,12H2,1H3
InChIKeyDNDHBSCLSYXZHF-UHFFFAOYSA-N
XLogP3.67
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3,4,5,6-pentamethyl-N-quinolin-5-ylbenzenesulfonamide
CID 3847613
N-(3,4-dihydro-2H-chromen-8-yl)-5-ethylthiophene-2-sulfonamide
CID 110870791
N-(3,4-dihydro-2H-chromen-8-yl)hydroxylamine
CID 57275899
3-(3,4-dihydro-2H-chromen-8-yl)-2-methylpyridine;methanamine
CID 165409090
N-(2,3-dihydro-1-benzofuran-7-yl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 110870916
N-(3,4-dihydro-2H-chromen-8-yl)pyridine-3-carboxamide
CID 110870764
2-chloro-4-methyl-N-quinolin-5-yl-1,3-thiazole-5-sulfonamide
CID 43456143
4-fluoro-2-methyl-N-quinolin-5-ylbenzenesulfonamide
CID 110734015
4-ethyl-N-quinolin-5-ylbenzenesulfonamide
CID 3753530
8-methyl-3,4-dihydro-2H-chromene;1,2,3,5-tetramethylbenzene
CID 158337388
N-(3,4-dihydro-2H-chromen-8-yl)-2-(4-methylphenoxy)acetamide
CID 110866955
3,4-dihydro-2H-pyrano[2,3-b]pyridine;ethane
CID 90688913

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide (CID 154839133) is N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide is Cc1ccc2ncccc2c1S(=O)(=O)Nc1cccc2c1OCCC2.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide?
The InChIKey is DNDHBSCLSYXZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3S/c1-13-9-10-16-15(7-3-11-20-16)19(13)25(22,23)21-17-8-2-5-14-6-4-12-24-18(14)17/h2-3,5,7-11,21H,4,6,12H2,1H3.
What are the key properties of N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide?
N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide has a molecular weight of 354.43 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-8-yl)-6-methylquinoline-5-sulfonamide is sourced from PubChem (CID 154839133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).