N-ethyl-N,5-dimethylpyridine-2-sulfinamide

C9H14N2OS — CID 156567219

IUPACN-ethyl-N,5-dimethylpyridine-2-sulfinamide
SMILESCCN(C)S(=O)c1ccc(C)cn1
InChIInChI=1S/C9H14N2OS/c1-4-11(3)13(12)9-6-5-8(2)7-10-9/h5-7H,4H2,1-3H3
InChIKeyYSLFZVVMBGGSBK-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.36
Rot. Bonds3

About N-ethyl-N,5-dimethylpyridine-2-sulfinamide

N-ethyl-N,5-dimethylpyridine-2-sulfinamide (PubChem CID 156567219) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is N-ethyl-N,5-dimethylpyridine-2-sulfinamide.

Molecular Properties

Compound NameN-ethyl-N,5-dimethylpyridine-2-sulfinamide
PubChem CID156567219
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC NameN-ethyl-N,5-dimethylpyridine-2-sulfinamide
SMILESCCN(C)S(=O)c1ccc(C)cn1
InChIInChI=1S/C9H14N2OS/c1-4-11(3)13(12)9-6-5-8(2)7-10-9/h5-7H,4H2,1-3H3
InChIKeyYSLFZVVMBGGSBK-UHFFFAOYSA-N
XLogP1.36
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,5-dimethylpyridine-2-sulfinamide?
The IUPAC name of N-ethyl-N,5-dimethylpyridine-2-sulfinamide (CID 156567219) is N-ethyl-N,5-dimethylpyridine-2-sulfinamide.
What is the SMILES notation for N-ethyl-N,5-dimethylpyridine-2-sulfinamide?
The canonical SMILES for N-ethyl-N,5-dimethylpyridine-2-sulfinamide is CCN(C)S(=O)c1ccc(C)cn1.
What is the InChIKey of N-ethyl-N,5-dimethylpyridine-2-sulfinamide?
The InChIKey is YSLFZVVMBGGSBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-4-11(3)13(12)9-6-5-8(2)7-10-9/h5-7H,4H2,1-3H3.
What are the key properties of N-ethyl-N,5-dimethylpyridine-2-sulfinamide?
N-ethyl-N,5-dimethylpyridine-2-sulfinamide has a molecular weight of 198.29 g/mol, XLogP of 1.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,5-dimethylpyridine-2-sulfinamide is sourced from PubChem (CID 156567219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).