5-propan-2-yloxyquinoline-8-sulfonamide

C12H14N2O3S — CID 103045315

IUPAC5-propan-2-yloxyquinoline-8-sulfonamide
SMILESCC(C)Oc1ccc(S(N)(=O)=O)c2ncccc12
InChIInChI=1S/C12H14N2O3S/c1-8(2)17-10-5-6-11(18(13,15)16)12-9(10)4-3-7-14-12/h3-8H,1-2H3,(H2,13,15,16)
InChIKeyUDISBYNBKZAQLY-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.67
Rot. Bonds3

About 5-propan-2-yloxyquinoline-8-sulfonamide

5-propan-2-yloxyquinoline-8-sulfonamide (PubChem CID 103045315) has the molecular formula C12H14N2O3S and a molecular weight of 266.32 g/mol. Its IUPAC name is 5-propan-2-yloxyquinoline-8-sulfonamide.

Molecular Properties

Compound Name5-propan-2-yloxyquinoline-8-sulfonamide
PubChem CID103045315
Molecular FormulaC12H14N2O3S
Molecular Weight266.32 g/mol
Exact Mass266.07
IUPAC Name5-propan-2-yloxyquinoline-8-sulfonamide
SMILESCC(C)Oc1ccc(S(N)(=O)=O)c2ncccc12
InChIInChI=1S/C12H14N2O3S/c1-8(2)17-10-5-6-11(18(13,15)16)12-9(10)4-3-7-14-12/h3-8H,1-2H3,(H2,13,15,16)
InChIKeyUDISBYNBKZAQLY-UHFFFAOYSA-N
XLogP1.67
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-propan-2-yloxyquinolin-8-amine
CID 43449641
8-propan-2-yloxyquinoline-5-sulfonyl chloride
CID 43115660
5-but-3-ynoxyquinoline-8-sulfonamide
CID 103045310
5-(2-methylidenebutoxy)quinoline-8-sulfonamide
CID 103045360
5-(3-methylbut-3-enoxy)quinoline-8-sulfonamide
CID 103045343
5-[(E)-3-chloroprop-2-enoxy]quinoline-8-sulfonamide
CID 103045348
5-(cyclobutylmethoxy)quinoline-8-sulfonamide
CID 103045327
N-[2-(2-isoquinolin-4-ylethynyl)phenyl]-5-propan-2-yloxyquinoline-8-sulfonamide
CID 175843247
4-propan-2-yloxyquinolin-8-amine
CID 83060477
8-[(E)-but-2-enoxy]quinoline-5-sulfonamide
CID 82921921
5-(4-methylpentoxy)quinoline-8-sulfonyl chloride
CID 103044656
8-phenylmethoxyquinoline-5-sulfonamide
CID 60758024

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yloxyquinoline-8-sulfonamide?
The IUPAC name of 5-propan-2-yloxyquinoline-8-sulfonamide (CID 103045315) is 5-propan-2-yloxyquinoline-8-sulfonamide.
What is the SMILES notation for 5-propan-2-yloxyquinoline-8-sulfonamide?
The canonical SMILES for 5-propan-2-yloxyquinoline-8-sulfonamide is CC(C)Oc1ccc(S(N)(=O)=O)c2ncccc12.
What is the InChIKey of 5-propan-2-yloxyquinoline-8-sulfonamide?
The InChIKey is UDISBYNBKZAQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3S/c1-8(2)17-10-5-6-11(18(13,15)16)12-9(10)4-3-7-14-12/h3-8H,1-2H3,(H2,13,15,16).
What are the key properties of 5-propan-2-yloxyquinoline-8-sulfonamide?
5-propan-2-yloxyquinoline-8-sulfonamide has a molecular weight of 266.32 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yloxyquinoline-8-sulfonamide is sourced from PubChem (CID 103045315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).