azanylidyne-oxo-propyl-λ6-sulfane

C3H7NOS — CID 90138662

IUPACazanylidyne-oxo-propyl-λ6-sulfane
SMILESCCCS(#N)=O
InChIInChI=1S/C3H7NOS/c1-2-3-6(4)5/h2-3H2,1H3
InChIKeyJRMRUFQTQMPLSK-UHFFFAOYSA-N
MW105.16 g/mol
LogP0.62
Rot. Bonds1

About azanylidyne-oxo-propyl-λ6-sulfane

azanylidyne-oxo-propyl-λ6-sulfane (PubChem CID 90138662) has the molecular formula C3H7NOS and a molecular weight of 105.16 g/mol. Its IUPAC name is azanylidyne-oxo-propyl-λ6-sulfane.

Molecular Properties

Compound Nameazanylidyne-oxo-propyl-λ6-sulfane
PubChem CID90138662
Molecular FormulaC3H7NOS
Molecular Weight105.16 g/mol
Exact Mass105.02
IUPAC Nameazanylidyne-oxo-propyl-λ6-sulfane
SMILESCCCS(#N)=O
InChIInChI=1S/C3H7NOS/c1-2-3-6(4)5/h2-3H2,1H3
InChIKeyJRMRUFQTQMPLSK-UHFFFAOYSA-N
XLogP0.62
TPSA40.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.16
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

platinum(2+);bis(1-propylsulfinylpropane);dichloride
CID 3082519
1-propylsulfinylbutane
CID 564183
azane;fluoro propane-1-sulfinate
CID 174229843
2-propylsulfinylbutanenitrile
CID 64690074
3-[(R)-propylsulfinyl]propan-1-amine
CID 88509307
propan-2-yl propane-1-sulfinate
CID 23271047
ethyl (R)-butane-1-sulfinate
CID 175883335
3-propylsulfinylpropan-1-amine
CID 58684721
N-ethyl-N-propylpropane-1-sulfinamide
CID 19873154
1-propylsulfinylpyrrolidine
CID 130963156
3-propylsulfinylbutan-2-one
CID 64638271
1-heptadecylsulfinylheptadecane
CID 54059826

Frequently Asked Questions

What is the IUPAC name of azanylidyne-oxo-propyl-λ6-sulfane?
The IUPAC name of azanylidyne-oxo-propyl-λ6-sulfane (CID 90138662) is azanylidyne-oxo-propyl-λ6-sulfane.
What is the SMILES notation for azanylidyne-oxo-propyl-λ6-sulfane?
The canonical SMILES for azanylidyne-oxo-propyl-λ6-sulfane is CCCS(#N)=O.
What is the InChIKey of azanylidyne-oxo-propyl-λ6-sulfane?
The InChIKey is JRMRUFQTQMPLSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NOS/c1-2-3-6(4)5/h2-3H2,1H3.
What are the key properties of azanylidyne-oxo-propyl-λ6-sulfane?
azanylidyne-oxo-propyl-λ6-sulfane has a molecular weight of 105.16 g/mol, XLogP of 0.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azanylidyne-oxo-propyl-λ6-sulfane is sourced from PubChem (CID 90138662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).