dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane

C8H12N2S — CID 59451914

IUPACdimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane
SMILESCc1cccc(N=S(C)C)n1
InChIInChI=1S/C8H12N2S/c1-7-5-4-6-8(9-7)10-11(2)3/h4-6H,1-3H3
InChIKeyPAIJOUJJAZZHSC-UHFFFAOYSA-N
MW168.26 g/mol
LogP2.08
Rot. Bonds1

About dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane

dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane (PubChem CID 59451914) has the molecular formula C8H12N2S and a molecular weight of 168.26 g/mol. Its IUPAC name is dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane.

Molecular Properties

Compound Namedimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane
PubChem CID59451914
Molecular FormulaC8H12N2S
Molecular Weight168.26 g/mol
Exact Mass168.07
IUPAC Namedimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane
SMILESCc1cccc(N=S(C)C)n1
InChIInChI=1S/C8H12N2S/c1-7-5-4-6-8(9-7)10-11(2)3/h4-6H,1-3H3
InChIKeyPAIJOUJJAZZHSC-UHFFFAOYSA-N
XLogP2.08
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane?
The IUPAC name of dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane (CID 59451914) is dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane.
What is the SMILES notation for dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane?
The canonical SMILES for dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane is Cc1cccc(N=S(C)C)n1.
What is the InChIKey of dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane?
The InChIKey is PAIJOUJJAZZHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2S/c1-7-5-4-6-8(9-7)10-11(2)3/h4-6H,1-3H3.
What are the key properties of dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane?
dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane has a molecular weight of 168.26 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(6-methyl-2-pyridinyl)imino]-λ4-sulfane is sourced from PubChem (CID 59451914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).