4-ethylsulfanyl-3-methylpyridin-2-amine

C8H12N2S — CID 142196523

IUPAC4-ethylsulfanyl-3-methylpyridin-2-amine
SMILESCCSc1ccnc(N)c1C
InChIInChI=1S/C8H12N2S/c1-3-11-7-4-5-10-8(9)6(7)2/h4-5H,3H2,1-2H3,(H2,9,10)
InChIKeyYCFMDKOVXPLSDW-UHFFFAOYSA-N
MW168.26 g/mol
LogP2.08
Rot. Bonds2

About 4-ethylsulfanyl-3-methylpyridin-2-amine

4-ethylsulfanyl-3-methylpyridin-2-amine (PubChem CID 142196523) has the molecular formula C8H12N2S and a molecular weight of 168.26 g/mol. Its IUPAC name is 4-ethylsulfanyl-3-methylpyridin-2-amine.

Molecular Properties

Compound Name4-ethylsulfanyl-3-methylpyridin-2-amine
PubChem CID142196523
Molecular FormulaC8H12N2S
Molecular Weight168.26 g/mol
Exact Mass168.07
IUPAC Name4-ethylsulfanyl-3-methylpyridin-2-amine
SMILESCCSc1ccnc(N)c1C
InChIInChI=1S/C8H12N2S/c1-3-11-7-4-5-10-8(9)6(7)2/h4-5H,3H2,1-2H3,(H2,9,10)
InChIKeyYCFMDKOVXPLSDW-UHFFFAOYSA-N
XLogP2.08
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethylsulfanyl-3-methylpyridin-2-amine?
The IUPAC name of 4-ethylsulfanyl-3-methylpyridin-2-amine (CID 142196523) is 4-ethylsulfanyl-3-methylpyridin-2-amine.
What is the SMILES notation for 4-ethylsulfanyl-3-methylpyridin-2-amine?
The canonical SMILES for 4-ethylsulfanyl-3-methylpyridin-2-amine is CCSc1ccnc(N)c1C.
What is the InChIKey of 4-ethylsulfanyl-3-methylpyridin-2-amine?
The InChIKey is YCFMDKOVXPLSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2S/c1-3-11-7-4-5-10-8(9)6(7)2/h4-5H,3H2,1-2H3,(H2,9,10).
What are the key properties of 4-ethylsulfanyl-3-methylpyridin-2-amine?
4-ethylsulfanyl-3-methylpyridin-2-amine has a molecular weight of 168.26 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylsulfanyl-3-methylpyridin-2-amine is sourced from PubChem (CID 142196523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).