N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide

C13H15NO3S — CID 103802489

IUPACN-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide
SMILESC[C@@H](CO)NS(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C13H15NO3S/c1-10(9-15)14-18(16,17)13-8-4-6-11-5-2-3-7-12(11)13/h2-8,10,14-15H,9H2,1H3/t10-/m0/s1
InChIKeyUNPCLTGJHHDYGB-JTQLQIEISA-N
MW265.33 g/mol
LogP1.50
Rot. Bonds4

About N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide

N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide (PubChem CID 103802489) has the molecular formula C13H15NO3S and a molecular weight of 265.33 g/mol. Its IUPAC name is N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide
PubChem CID103802489
Molecular FormulaC13H15NO3S
Molecular Weight265.33 g/mol
Exact Mass265.08
IUPAC NameN-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide
SMILESC[C@@H](CO)NS(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C13H15NO3S/c1-10(9-15)14-18(16,17)13-8-4-6-11-5-2-3-7-12(11)13/h2-8,10,14-15H,9H2,1H3/t10-/m0/s1
InChIKeyUNPCLTGJHHDYGB-JTQLQIEISA-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-(5-methylhexan-2-yl)naphthalene-1-sulfonamide
CID 114795789
(2R)-2-(naphthalen-1-ylsulfonylamino)propanoic acid
CID 103862696
N-(4-bromobutan-2-yl)naphthalene-1-sulfonamide
CID 114795686
2-methyl-3-(naphthalen-1-ylsulfonylamino)butanoic acid
CID 114795460
N-(1-ethylsulfanylpropan-2-yl)naphthalene-1-sulfonamide
CID 115684220
N-(3-ethylpentan-2-yl)naphthalene-1-sulfonamide
CID 114795805
2-[[(2S)-1-hydroxypropan-2-yl]sulfamoyl]benzoic acid
CID 107215504
N-[(2R)-1-hydroxypropan-2-yl]-2-methoxybenzenesulfonamide
CID 79027643
N-(1-cyanoethyl)naphthalene-1-sulfonamide
CID 115766500
N-(5-hydroxy-4-methylpentyl)naphthalene-1-sulfonamide
CID 103858821
N-[(2R)-1-morpholin-4-ylpropan-2-yl]naphthalene-1-sulfonamide
CID 97000893
N-[1-(4-chlorophenyl)ethyl]naphthalene-1-sulfonamide
CID 3415984

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide?
The IUPAC name of N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide (CID 103802489) is N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide.
What is the SMILES notation for N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide?
The canonical SMILES for N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide is C[C@@H](CO)NS(=O)(=O)c1cccc2ccccc12.
What is the InChIKey of N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide?
The InChIKey is UNPCLTGJHHDYGB-JTQLQIEISA-N. The full InChI is InChI=1S/C13H15NO3S/c1-10(9-15)14-18(16,17)13-8-4-6-11-5-2-3-7-12(11)13/h2-8,10,14-15H,9H2,1H3/t10-/m0/s1.
What are the key properties of N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide?
N-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-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-[(2S)-1-hydroxypropan-2-yl]naphthalene-1-sulfonamide is sourced from PubChem (CID 103802489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).