imino-oxo-dipropyl-λ6-sulfane

C6H15NOS — CID 87365843

IUPACimino-oxo-dipropyl-λ6-sulfane
SMILES[H]N=S(=O)(CCC)CCC
InChIInChI=1S/C6H15NOS/c1-3-5-9(7,8)6-4-2/h7H,3-6H2,1-2H3
InChIKeyXYCNIAHDPCZQAR-UHFFFAOYSA-N
MW149.26 g/mol
LogP1.85
Rot. Bonds4

About imino-oxo-dipropyl-λ6-sulfane

imino-oxo-dipropyl-λ6-sulfane (PubChem CID 87365843) has the molecular formula C6H15NOS and a molecular weight of 149.26 g/mol. Its IUPAC name is imino-oxo-dipropyl-λ6-sulfane.

Molecular Properties

Compound Nameimino-oxo-dipropyl-λ6-sulfane
PubChem CID87365843
Molecular FormulaC6H15NOS
Molecular Weight149.26 g/mol
Exact Mass149.09
IUPAC Nameimino-oxo-dipropyl-λ6-sulfane
SMILES[H]N=S(=O)(CCC)CCC
InChIInChI=1S/C6H15NOS/c1-3-5-9(7,8)6-4-2/h7H,3-6H2,1-2H3
InChIKeyXYCNIAHDPCZQAR-UHFFFAOYSA-N
XLogP1.85
TPSA40.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.26
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,1'-Sulfinylbis(propane)
CID 20252
S,S-tetramethylenesulfoximide
CID 11274993
Diethyl(imino)-lambda6-sulfanone
CID 13600392
1-Imino-1lambda6-thian-1-one
CID 21684566
Butane, 1-(ethylsulfinyl)-
CID 533730
2-(S-methylsulfonimidoyl)butane
CID 137698553
S,S-dibutyl-sulfoximide
CID 12456444
Imino(methyl)(3-methylbutyl)-lambda6-sulfanone
CID 134335189
Cyclopentyl(imino)(methyl)-l6-sulfanone
CID 122420492
Imino-oxo-propan-2-yl-(3,3,3-trifluoropropyl)-lambda6-sulfane
CID 176888021
sec-Butyl ethyl sulfoxide
CID 522633
Ethyl-hexyl-imino-oxo-sulfane
CID 134895845

Frequently Asked Questions

What is the IUPAC name of imino-oxo-dipropyl-λ6-sulfane?
The IUPAC name of imino-oxo-dipropyl-λ6-sulfane (CID 87365843) is imino-oxo-dipropyl-λ6-sulfane.
What is the SMILES notation for imino-oxo-dipropyl-λ6-sulfane?
The canonical SMILES for imino-oxo-dipropyl-λ6-sulfane is [H]N=S(=O)(CCC)CCC.
What is the InChIKey of imino-oxo-dipropyl-λ6-sulfane?
The InChIKey is XYCNIAHDPCZQAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NOS/c1-3-5-9(7,8)6-4-2/h7H,3-6H2,1-2H3.
What are the key properties of imino-oxo-dipropyl-λ6-sulfane?
imino-oxo-dipropyl-λ6-sulfane has a molecular weight of 149.26 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for imino-oxo-dipropyl-λ6-sulfane is sourced from PubChem (CID 87365843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).