N-(2-hydroxypropyl)naphthalene-2-sulfonamide

C13H15NO3S — CID 43394412

IUPACN-(2-hydroxypropyl)naphthalene-2-sulfonamide
SMILESCC(O)CNS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C13H15NO3S/c1-10(15)9-14-18(16,17)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,10,14-15H,9H2,1H3
InChIKeyHZVXIOZTMHQDQI-UHFFFAOYSA-N
MW265.33 g/mol
LogP1.50
Rot. Bonds4

About N-(2-hydroxypropyl)naphthalene-2-sulfonamide

N-(2-hydroxypropyl)naphthalene-2-sulfonamide (PubChem CID 43394412) has the molecular formula C13H15NO3S and a molecular weight of 265.33 g/mol. Its IUPAC name is N-(2-hydroxypropyl)naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)naphthalene-2-sulfonamide
PubChem CID43394412
Molecular FormulaC13H15NO3S
Molecular Weight265.33 g/mol
Exact Mass265.08
IUPAC NameN-(2-hydroxypropyl)naphthalene-2-sulfonamide
SMILESCC(O)CNS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C13H15NO3S/c1-10(15)9-14-18(16,17)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,10,14-15H,9H2,1H3
InChIKeyHZVXIOZTMHQDQI-UHFFFAOYSA-N
XLogP1.50
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,3-difluoro-2-hydroxypropyl)naphthalene-2-sulfonamide
CID 103836737
N-[(2R)-2-(ethylamino)propyl]naphthalene-2-sulfonamide;hydrochloride
CID 120664537
N-[2-(naphthalen-2-ylsulfonylamino)ethyl]naphthalene-2-sulfonamide
CID 30170513
N-[2-hydroxy-2-(3-methylthiophen-2-yl)ethyl]naphthalene-2-sulfonamide
CID 90496859
2-(naphthalen-2-ylsulfonylamino)ethyl-di(propan-2-yl)azanium
CID 2459418
4-bromo-N-[(2S)-2-hydroxypropyl]-3-methylbenzenesulfonamide
CID 51681214
N-(3-hydroxy-3-phenylpropyl)naphthalene-2-sulfonamide
CID 90499632
4-fluoro-N-(2-hydroxypropyl)benzenesulfonamide
CID 43394414
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]naphthalene-2-sulfonamide
CID 79255723
N-(2-ethyl-2-hydroxybutyl)naphthalene-2-sulfonamide
CID 65112958
3-chloro-4-fluoro-N-(2-hydroxypropyl)benzenesulfonamide
CID 43502351
N-[(2R)-2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]naphthalene-2-sulfonamide
CID 7497879

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)naphthalene-2-sulfonamide?
The IUPAC name of N-(2-hydroxypropyl)naphthalene-2-sulfonamide (CID 43394412) is N-(2-hydroxypropyl)naphthalene-2-sulfonamide.
What is the SMILES notation for N-(2-hydroxypropyl)naphthalene-2-sulfonamide?
The canonical SMILES for N-(2-hydroxypropyl)naphthalene-2-sulfonamide is CC(O)CNS(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(2-hydroxypropyl)naphthalene-2-sulfonamide?
The InChIKey is HZVXIOZTMHQDQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3S/c1-10(15)9-14-18(16,17)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,10,14-15H,9H2,1H3.
What are the key properties of N-(2-hydroxypropyl)naphthalene-2-sulfonamide?
N-(2-hydroxypropyl)naphthalene-2-sulfonamide has a molecular weight of 265.33 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)naphthalene-2-sulfonamide is sourced from PubChem (CID 43394412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).