2-non-1-enoxybenzenesulfonamide

C15H23NO3S — CID 175911128

IUPAC2-non-1-enoxybenzenesulfonamide
SMILESCCCCCCCC=COc1ccccc1S(N)(=O)=O
InChIInChI=1S/C15H23NO3S/c1-2-3-4-5-6-7-10-13-19-14-11-8-9-12-15(14)20(16,17)18/h8-13H,2-7H2,1H3,(H2,16,17,18)
InChIKeyAHCACCADJJXSEU-UHFFFAOYSA-N
MW297.42 g/mol
LogP3.59
Rot. Bonds9

About 2-non-1-enoxybenzenesulfonamide

2-non-1-enoxybenzenesulfonamide (PubChem CID 175911128) has the molecular formula C15H23NO3S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-non-1-enoxybenzenesulfonamide.

Molecular Properties

Compound Name2-non-1-enoxybenzenesulfonamide
PubChem CID175911128
Molecular FormulaC15H23NO3S
Molecular Weight297.42 g/mol
Exact Mass297.14
IUPAC Name2-non-1-enoxybenzenesulfonamide
SMILESCCCCCCCC=COc1ccccc1S(N)(=O)=O
InChIInChI=1S/C15H23NO3S/c1-2-3-4-5-6-7-10-13-19-14-11-8-9-12-15(14)20(16,17)18/h8-13H,2-7H2,1H3,(H2,16,17,18)
InChIKeyAHCACCADJJXSEU-UHFFFAOYSA-N
XLogP3.59
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-heptadec-1-enoxy-2-methylbenzene
CID 156783905
1-henicos-1-enoxy-2-methylbenzene
CID 156783878
2-[(9Z,12Z)-octadeca-9,12-dienyl]benzenesulfonamide
CID 175087049
2-nonylbenzenesulfonamide
CID 70447042
3-hydroxy-5-undec-1-enoxynaphthalene-2-carboxylic acid
CID 54431654
2-hexoxypyridine-3-sulfonamide
CID 112572977
4-dodecoxynaphthalene-1-sulfonamide
CID 54239481
decyl 2-sulfamoylbenzoate
CID 139665617
2-prop-2-enoxybenzenesulfonamide
CID 13321757
2,3-bis[[(E)-tricos-1-enoxy]carbonyl]benzenesulfonic acid
CID 101309582
2,3-bis[[(E)-oct-1-enoxy]carbonyl]benzenesulfonic acid
CID 101307902
2,3-bis[[(E)-nonadec-1-enoxy]carbonyl]benzenesulfonic acid
CID 101308958

Frequently Asked Questions

What is the IUPAC name of 2-non-1-enoxybenzenesulfonamide?
The IUPAC name of 2-non-1-enoxybenzenesulfonamide (CID 175911128) is 2-non-1-enoxybenzenesulfonamide.
What is the SMILES notation for 2-non-1-enoxybenzenesulfonamide?
The canonical SMILES for 2-non-1-enoxybenzenesulfonamide is CCCCCCCC=COc1ccccc1S(N)(=O)=O.
What is the InChIKey of 2-non-1-enoxybenzenesulfonamide?
The InChIKey is AHCACCADJJXSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3S/c1-2-3-4-5-6-7-10-13-19-14-11-8-9-12-15(14)20(16,17)18/h8-13H,2-7H2,1H3,(H2,16,17,18).
What are the key properties of 2-non-1-enoxybenzenesulfonamide?
2-non-1-enoxybenzenesulfonamide has a molecular weight of 297.42 g/mol, XLogP of 3.59, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-non-1-enoxybenzenesulfonamide is sourced from PubChem (CID 175911128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).