6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine

C12H11FN2S — CID 141216984

IUPAC6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine
SMILESCSc1ccc(-c2ccc(N)cn2)c(F)c1
InChIInChI=1S/C12H11FN2S/c1-16-9-3-4-10(11(13)6-9)12-5-2-8(14)7-15-12/h2-7H,14H2,1H3
InChIKeyDDJAEULSOMWTSP-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.19
Rot. Bonds2

About 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine

6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine (PubChem CID 141216984) has the molecular formula C12H11FN2S and a molecular weight of 234.30 g/mol. Its IUPAC name is 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine.

Molecular Properties

Compound Name6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine
PubChem CID141216984
Molecular FormulaC12H11FN2S
Molecular Weight234.30 g/mol
Exact Mass234.06
IUPAC Name6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine
SMILESCSc1ccc(-c2ccc(N)cn2)c(F)c1
InChIInChI=1S/C12H11FN2S/c1-16-9-3-4-10(11(13)6-9)12-5-2-8(14)7-15-12/h2-7H,14H2,1H3
InChIKeyDDJAEULSOMWTSP-UHFFFAOYSA-N
XLogP3.19
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-fluoro-4-methylsulfanylphenyl)-1H-pyrazol-5-amine
CID 117319576
5-amino-2-(5-amino-2-pyridinyl)phenol
CID 175138948
6-(3,4-difluorophenyl)sulfanylpyridin-3-amine
CID 43345149
6-[2-methyl-4-(trifluoromethyl)phenyl]pyridin-3-amine
CID 102755510
2-(2,4-difluorophenyl)-5-fluoropyridine
CID 130334925
6-(2-chloro-4-methylphenyl)pyridin-3-amine
CID 144687572
6-(5-amino-2-pyridinyl)pyridin-3-amine;dihydrochloride
CID 11557953
1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol
CID 143762249
6-methylsulfanylpyridin-3-amine
CID 10261179
2-fluoro-1-(2-fluoro-4-methylsulfanylphenyl)sulfanyl-4-methylsulfanylbenzene
CID 139623422
2-[2,4-bis(methylsulfanyl)phenyl]pyridine
CID 134966043
3-(5-fluoro-2-pyridinyl)-4-methylaniline
CID 169175841

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine?
The IUPAC name of 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine (CID 141216984) is 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine.
What is the SMILES notation for 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine?
The canonical SMILES for 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine is CSc1ccc(-c2ccc(N)cn2)c(F)c1.
What is the InChIKey of 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine?
The InChIKey is DDJAEULSOMWTSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2S/c1-16-9-3-4-10(11(13)6-9)12-5-2-8(14)7-15-12/h2-7H,14H2,1H3.
What are the key properties of 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine?
6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine has a molecular weight of 234.30 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-4-methylsulfanylphenyl)pyridin-3-amine is sourced from PubChem (CID 141216984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).