N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide

C16H15N3O3S — CID 47038312

IUPACN-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide
SMILESCOc1ncccc1NS(=O)(=O)c1cccc2cc(C)cnc12
InChIInChI=1S/C16H15N3O3S/c1-11-9-12-5-3-7-14(15(12)18-10-11)23(20,21)19-13-6-4-8-17-16(13)22-2/h3-10,19H,1-2H3
InChIKeyGZSMCUZPAHSUDM-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.75
Rot. Bonds4

About N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide

N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide (PubChem CID 47038312) has the molecular formula C16H15N3O3S and a molecular weight of 329.38 g/mol. Its IUPAC name is N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide.

Molecular Properties

Compound NameN-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide
PubChem CID47038312
Molecular FormulaC16H15N3O3S
Molecular Weight329.38 g/mol
Exact Mass329.08
IUPAC NameN-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide
SMILESCOc1ncccc1NS(=O)(=O)c1cccc2cc(C)cnc12
InChIInChI=1S/C16H15N3O3S/c1-11-9-12-5-3-7-14(15(12)18-10-11)23(20,21)19-13-6-4-8-17-16(13)22-2/h3-10,19H,1-2H3
InChIKeyGZSMCUZPAHSUDM-UHFFFAOYSA-N
XLogP2.75
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxyphenyl)-3-methylquinoline-8-sulfonamide
CID 31046324
N-(5-bromo-2-methoxyphenyl)-3-methylquinoline-8-sulfonamide
CID 60533343
N-(2,4-dimethylphenyl)-3-methylquinoline-8-sulfonamide
CID 31046311
3-methyl-N-(2,3,4-trifluorophenyl)quinoline-8-sulfonamide
CID 25333424
N-(2-fluoro-4-methylphenyl)-3-methylquinoline-8-sulfonamide
CID 31046482
N-(2,3-dimethoxyphenyl)quinoline-8-sulfonamide
CID 3866922
methyl 2-[(3-methylquinolin-8-yl)sulfonylamino]acetate
CID 43422932
N-(3-iodophenyl)-3-methylquinoline-8-sulfonamide
CID 31690873
3-methyl-N-propan-2-ylquinoline-8-sulfonamide
CID 60721828
N-(2,4-dimethylphenyl)quinoline-8-sulfonamide
CID 4067742
6-methyl-N-(2-methylphenyl)quinoline-8-sulfonamide
CID 7304307
2,5-dimethoxy-N-(2-methoxy-3-pyridinyl)benzenesulfonamide
CID 47038313

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide?
The IUPAC name of N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide (CID 47038312) is N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide.
What is the SMILES notation for N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide?
The canonical SMILES for N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide is COc1ncccc1NS(=O)(=O)c1cccc2cc(C)cnc12.
What is the InChIKey of N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide?
The InChIKey is GZSMCUZPAHSUDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S/c1-11-9-12-5-3-7-14(15(12)18-10-11)23(20,21)19-13-6-4-8-17-16(13)22-2/h3-10,19H,1-2H3.
What are the key properties of N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide?
N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide has a molecular weight of 329.38 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-3-pyridinyl)-3-methylquinoline-8-sulfonamide is sourced from PubChem (CID 47038312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).