2-(naphthalen-1-ylsulfonylamino)guanidine

C11H12N4O2S — CID 4143375

IUPAC2-(naphthalen-1-ylsulfonylamino)guanidine
SMILESNC(N)=NNS(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C11H12N4O2S/c12-11(13)14-15-18(16,17)10-7-3-5-8-4-1-2-6-9(8)10/h1-7,15H,(H4,12,13,14)
InChIKeySFLSAUQGWURRKU-UHFFFAOYSA-N
MW264.31 g/mol
LogP0.31
Rot. Bonds3

About 2-(naphthalen-1-ylsulfonylamino)guanidine

2-(naphthalen-1-ylsulfonylamino)guanidine (PubChem CID 4143375) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is 2-(naphthalen-1-ylsulfonylamino)guanidine.

Molecular Properties

Compound Name2-(naphthalen-1-ylsulfonylamino)guanidine
PubChem CID4143375
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC Name2-(naphthalen-1-ylsulfonylamino)guanidine
SMILESNC(N)=NNS(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C11H12N4O2S/c12-11(13)14-15-18(16,17)10-7-3-5-8-4-1-2-6-9(8)10/h1-7,15H,(H4,12,13,14)
InChIKeySFLSAUQGWURRKU-UHFFFAOYSA-N
XLogP0.31
TPSA110.57 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-1-ylsulfonylamino)guanidine?
The IUPAC name of 2-(naphthalen-1-ylsulfonylamino)guanidine (CID 4143375) is 2-(naphthalen-1-ylsulfonylamino)guanidine.
What is the SMILES notation for 2-(naphthalen-1-ylsulfonylamino)guanidine?
The canonical SMILES for 2-(naphthalen-1-ylsulfonylamino)guanidine is NC(N)=NNS(=O)(=O)c1cccc2ccccc12.
What is the InChIKey of 2-(naphthalen-1-ylsulfonylamino)guanidine?
The InChIKey is SFLSAUQGWURRKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c12-11(13)14-15-18(16,17)10-7-3-5-8-4-1-2-6-9(8)10/h1-7,15H,(H4,12,13,14).
What are the key properties of 2-(naphthalen-1-ylsulfonylamino)guanidine?
2-(naphthalen-1-ylsulfonylamino)guanidine has a molecular weight of 264.31 g/mol, XLogP of 0.31, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-1-ylsulfonylamino)guanidine is sourced from PubChem (CID 4143375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).