1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide

C17H15NO3S — CID 146459884

IUPAC1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1ccccc1)c1ccc2ccccc2c1CO
InChIInChI=1S/C17H15NO3S/c19-12-16-15-9-5-4-6-13(15)10-11-17(16)22(20,21)18-14-7-2-1-3-8-14/h1-11,18-19H,12H2
InChIKeyIYZILUUIPRDSKZ-UHFFFAOYSA-N
MW313.38 g/mol
LogP3.13
Rot. Bonds4

About 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide

1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide (PubChem CID 146459884) has the molecular formula C17H15NO3S and a molecular weight of 313.38 g/mol. Its IUPAC name is 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide.

Molecular Properties

Compound Name1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide
PubChem CID146459884
Molecular FormulaC17H15NO3S
Molecular Weight313.38 g/mol
Exact Mass313.08
IUPAC Name1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1ccccc1)c1ccc2ccccc2c1CO
InChIInChI=1S/C17H15NO3S/c19-12-16-15-9-5-4-6-13(15)10-11-17(16)22(20,21)18-14-7-2-1-3-8-14/h1-11,18-19H,12H2
InChIKeyIYZILUUIPRDSKZ-UHFFFAOYSA-N
XLogP3.13
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenylnaphthalene-1-sulfonamide
CID 3816137
N-(4-anilinophenyl)naphthalene-1-sulfonamide
CID 86182181
N-(4-phenoxyphenyl)naphthalene-1-sulfonamide
CID 134137484
1-anilinonaphthalene-2-sulfonic acid
CID 14694055
7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide
CID 1376755
1-benzylnaphthalene-2-sulfonic acid
CID 20531531
1-hydroxy-4-(phenylsulfamoyl)naphthalene-2-carboxylic acid
CID 126480790
2-methyl-N-phenylbenzenesulfonamide
CID 3017048
2-hydroxy-4-methyl-N-phenylbenzenesulfonamide
CID 173356701
N-[4-(naphthalen-1-ylsulfonylamino)phenyl]sulfonylacetamide
CID 10501408
2-chloro-N-[4-(methanesulfonamido)phenyl]naphthalene-1-sulfonamide
CID 166231972
1-(hydroxymethyl)naphthalene-2-carbaldehyde
CID 21242059

Frequently Asked Questions

What is the IUPAC name of 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide?
The IUPAC name of 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide (CID 146459884) is 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide.
What is the SMILES notation for 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide?
The canonical SMILES for 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide is O=S(=O)(Nc1ccccc1)c1ccc2ccccc2c1CO.
What is the InChIKey of 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide?
The InChIKey is IYZILUUIPRDSKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3S/c19-12-16-15-9-5-4-6-13(15)10-11-17(16)22(20,21)18-14-7-2-1-3-8-14/h1-11,18-19H,12H2.
What are the key properties of 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide?
1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide has a molecular weight of 313.38 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(hydroxymethyl)-N-phenylnaphthalene-2-sulfonamide is sourced from PubChem (CID 146459884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).