N-ethyl-6-ethylsulfanylpyridin-2-amine

C9H14N2S — CID 80888584

IUPACN-ethyl-6-ethylsulfanylpyridin-2-amine
SMILESCCNc1cccc(SCC)n1
InChIInChI=1S/C9H14N2S/c1-3-10-8-6-5-7-9(11-8)12-4-2/h5-7H,3-4H2,1-2H3,(H,10,11)
InChIKeyAMFJPMLGJDFURU-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.63
Rot. Bonds4

About N-ethyl-6-ethylsulfanylpyridin-2-amine

N-ethyl-6-ethylsulfanylpyridin-2-amine (PubChem CID 80888584) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is N-ethyl-6-ethylsulfanylpyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-6-ethylsulfanylpyridin-2-amine
PubChem CID80888584
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC NameN-ethyl-6-ethylsulfanylpyridin-2-amine
SMILESCCNc1cccc(SCC)n1
InChIInChI=1S/C9H14N2S/c1-3-10-8-6-5-7-9(11-8)12-4-2/h5-7H,3-4H2,1-2H3,(H,10,11)
InChIKeyAMFJPMLGJDFURU-UHFFFAOYSA-N
XLogP2.63
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-ethylsulfanylpyridin-2-amine?
The IUPAC name of N-ethyl-6-ethylsulfanylpyridin-2-amine (CID 80888584) is N-ethyl-6-ethylsulfanylpyridin-2-amine.
What is the SMILES notation for N-ethyl-6-ethylsulfanylpyridin-2-amine?
The canonical SMILES for N-ethyl-6-ethylsulfanylpyridin-2-amine is CCNc1cccc(SCC)n1.
What is the InChIKey of N-ethyl-6-ethylsulfanylpyridin-2-amine?
The InChIKey is AMFJPMLGJDFURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c1-3-10-8-6-5-7-9(11-8)12-4-2/h5-7H,3-4H2,1-2H3,(H,10,11).
What are the key properties of N-ethyl-6-ethylsulfanylpyridin-2-amine?
N-ethyl-6-ethylsulfanylpyridin-2-amine has a molecular weight of 182.29 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-ethylsulfanylpyridin-2-amine is sourced from PubChem (CID 80888584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).