2-(naphthalen-2-ylsulfonylamino)acetic acid

C12H11NO4S — CID 702481

IUPAC2-(naphthalen-2-ylsulfonylamino)acetic acid
SMILESO=C(O)CNS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C12H11NO4S/c14-12(15)8-13-18(16,17)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,13H,8H2,(H,14,15)
InChIKeyMTFDMQASMMCFHB-UHFFFAOYSA-N
MW265.29 g/mol
LogP1.20
Rot. Bonds4

About 2-(naphthalen-2-ylsulfonylamino)acetic acid

2-(naphthalen-2-ylsulfonylamino)acetic acid (PubChem CID 702481) has the molecular formula C12H11NO4S and a molecular weight of 265.29 g/mol. Its IUPAC name is 2-(naphthalen-2-ylsulfonylamino)acetic acid.

Molecular Properties

Compound Name2-(naphthalen-2-ylsulfonylamino)acetic acid
PubChem CID702481
Molecular FormulaC12H11NO4S
Molecular Weight265.29 g/mol
Exact Mass265.04
IUPAC Name2-(naphthalen-2-ylsulfonylamino)acetic acid
SMILESO=C(O)CNS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C12H11NO4S/c14-12(15)8-13-18(16,17)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,13H,8H2,(H,14,15)
InChIKeyMTFDMQASMMCFHB-UHFFFAOYSA-N
XLogP1.20
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-((4-Methylphenyl)sulfonyl)glycine
CID 70653
3-(5,6,7,8-Tetrahydronaphthalene-2-sulfonamido)propanoic acid
CID 4868381
4-(Naphthalene-2-sulfonamido)butanoic acid
CID 362742
(Biphenyl-4-sulfonylamino)-acetic acid
CID 893637
3-(Naphthalene-2-sulfonamido)propanoic acid
CID 362740
Biphenylsulfonamide carboxylate, 11
CID 24901481
n-Methylnaphthalene-2-sulfonamide
CID 233072
n-Hydroxy-2-(naphthalene-2-sulfonylamino)-acetamide
CID 57398187
(((7-(((Carboxymethyl)amino)sulfonyl)-9H-fluoren-2-YL)sulfonyl)amino)acetic acid
CID 1943367
3-[(6-Methylnaphthalen-2-yl)sulfonylamino]propanoic acid
CID 1242537
2-[(2-Naphthylsulfonyl)amino]ethyl dihydrogen phosphate
CID 11473003
Methyl 3-[(2-naphthylsulfonyl)amino]propanoate
CID 3913914

Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-2-ylsulfonylamino)acetic acid?
The IUPAC name of 2-(naphthalen-2-ylsulfonylamino)acetic acid (CID 702481) is 2-(naphthalen-2-ylsulfonylamino)acetic acid.
What is the SMILES notation for 2-(naphthalen-2-ylsulfonylamino)acetic acid?
The canonical SMILES for 2-(naphthalen-2-ylsulfonylamino)acetic acid is O=C(O)CNS(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of 2-(naphthalen-2-ylsulfonylamino)acetic acid?
The InChIKey is MTFDMQASMMCFHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO4S/c14-12(15)8-13-18(16,17)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,13H,8H2,(H,14,15).
What are the key properties of 2-(naphthalen-2-ylsulfonylamino)acetic acid?
2-(naphthalen-2-ylsulfonylamino)acetic acid has a molecular weight of 265.29 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-2-ylsulfonylamino)acetic acid is sourced from PubChem (CID 702481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).