azanylidyne-diphenyl-propoxy-lambda6-sulfane

C15H17NOS — CID 15688898

IUPACazanylidyne-diphenyl-propoxy-lambda6-sulfane
SMILESCCCOS(#N)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H17NOS/c1-2-13-17-18(16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
InChIKeyZNTGCIDFPGBCMY-UHFFFAOYSA-N
MW259.37 g/mol
LogP4.73
Rot. Bonds2

About azanylidyne-diphenyl-propoxy-lambda6-sulfane

azanylidyne-diphenyl-propoxy-lambda6-sulfane (PubChem CID 15688898) has the molecular formula C15H17NOS and a molecular weight of 259.37 g/mol. Its IUPAC name is azanylidyne-diphenyl-propoxy-lambda6-sulfane.

Molecular Properties

Compound Nameazanylidyne-diphenyl-propoxy-lambda6-sulfane
PubChem CID15688898
Molecular FormulaC15H17NOS
Molecular Weight259.37 g/mol
Exact Mass259.10
IUPAC Nameazanylidyne-diphenyl-propoxy-lambda6-sulfane
SMILESCCCOS(#N)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H17NOS/c1-2-13-17-18(16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
InChIKeyZNTGCIDFPGBCMY-UHFFFAOYSA-N
XLogP4.73
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.37
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azanylidyne-diphenyl-propoxy-lambda6-sulfane?
The IUPAC name of azanylidyne-diphenyl-propoxy-lambda6-sulfane (CID 15688898) is azanylidyne-diphenyl-propoxy-lambda6-sulfane.
What is the SMILES notation for azanylidyne-diphenyl-propoxy-lambda6-sulfane?
The canonical SMILES for azanylidyne-diphenyl-propoxy-lambda6-sulfane is CCCOS(#N)(c1ccccc1)c1ccccc1.
What is the InChIKey of azanylidyne-diphenyl-propoxy-lambda6-sulfane?
The InChIKey is ZNTGCIDFPGBCMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NOS/c1-2-13-17-18(16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3.
What are the key properties of azanylidyne-diphenyl-propoxy-lambda6-sulfane?
azanylidyne-diphenyl-propoxy-lambda6-sulfane has a molecular weight of 259.37 g/mol, XLogP of 4.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azanylidyne-diphenyl-propoxy-lambda6-sulfane is sourced from PubChem (CID 15688898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).