naphthalen-2-yl sulfamate

C10H9NO3S — CID 21149346

IUPACnaphthalen-2-yl sulfamate
SMILESNS(=O)(=O)Oc1ccc2ccccc2c1
InChIInChI=1S/C10H9NO3S/c11-15(12,13)14-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H2,11,12,13)
InChIKeyGQQGUUOAPRUTQW-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.42
Rot. Bonds2

About naphthalen-2-yl sulfamate

naphthalen-2-yl sulfamate (PubChem CID 21149346) has the molecular formula C10H9NO3S and a molecular weight of 223.25 g/mol. Its IUPAC name is naphthalen-2-yl sulfamate.

Molecular Properties

Compound Namenaphthalen-2-yl sulfamate
PubChem CID21149346
Molecular FormulaC10H9NO3S
Molecular Weight223.25 g/mol
Exact Mass223.03
IUPAC Namenaphthalen-2-yl sulfamate
SMILESNS(=O)(=O)Oc1ccc2ccccc2c1
InChIInChI=1S/C10H9NO3S/c11-15(12,13)14-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H2,11,12,13)
InChIKeyGQQGUUOAPRUTQW-UHFFFAOYSA-N
XLogP1.42
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of naphthalen-2-yl sulfamate?
The IUPAC name of naphthalen-2-yl sulfamate (CID 21149346) is naphthalen-2-yl sulfamate.
What is the SMILES notation for naphthalen-2-yl sulfamate?
The canonical SMILES for naphthalen-2-yl sulfamate is NS(=O)(=O)Oc1ccc2ccccc2c1.
What is the InChIKey of naphthalen-2-yl sulfamate?
The InChIKey is GQQGUUOAPRUTQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO3S/c11-15(12,13)14-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H2,11,12,13).
What are the key properties of naphthalen-2-yl sulfamate?
naphthalen-2-yl sulfamate has a molecular weight of 223.25 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-2-yl sulfamate is sourced from PubChem (CID 21149346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).