ethane;3-methylsulfanylpyridin-2-amine

C8H14N2S — CID 142810881

IUPACethane;3-methylsulfanylpyridin-2-amine
SMILESCC.CSc1cccnc1N
InChIInChI=1S/C6H8N2S.C2H6/c1-9-5-3-2-4-8-6(5)7;1-2/h2-4H,1H3,(H2,7,8);1-2H3
InChIKeyDECOFCFGMMUXKM-UHFFFAOYSA-N
MW170.28 g/mol
LogP2.41
Rot. Bonds1

About ethane;3-methylsulfanylpyridin-2-amine

ethane;3-methylsulfanylpyridin-2-amine (PubChem CID 142810881) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is ethane;3-methylsulfanylpyridin-2-amine.

Molecular Properties

Compound Nameethane;3-methylsulfanylpyridin-2-amine
PubChem CID142810881
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC Nameethane;3-methylsulfanylpyridin-2-amine
SMILESCC.CSc1cccnc1N
InChIInChI=1S/C6H8N2S.C2H6/c1-9-5-3-2-4-8-6(5)7;1-2/h2-4H,1H3,(H2,7,8);1-2H3
InChIKeyDECOFCFGMMUXKM-UHFFFAOYSA-N
XLogP2.41
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-amino-3-pyridinyl) thiohypofluorite
CID 143924195
3-methylsulfanyl-2-propan-2-ylpyridine
CID 18741288
2-methyl-3-methylsulfanylpyridine;propane
CID 142465096
2-isocyano-3-methylsulfanylpyridine
CID 23383667
3-(2-amino-3-pyridinyl)pyridin-2-amine
CID 1236677
3-methylsulfanyl-2-methylsulfonylpyridine
CID 23436875
methoxymethane;3-methylpyridin-2-amine
CID 142348172
ethane;5-methyl-3-methylsulfanylpyridin-2-amine
CID 171527271
2-(2-amino-3-pyridinyl)-2-methylsulfanylacetaldehyde
CID 119090776
4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine
CID 118248035
3-methylsulfanyl-2-nitropyridine
CID 130771705
2-aminopyridine-3-carbonitrile;ethane
CID 144683018

Frequently Asked Questions

What is the IUPAC name of ethane;3-methylsulfanylpyridin-2-amine?
The IUPAC name of ethane;3-methylsulfanylpyridin-2-amine (CID 142810881) is ethane;3-methylsulfanylpyridin-2-amine.
What is the SMILES notation for ethane;3-methylsulfanylpyridin-2-amine?
The canonical SMILES for ethane;3-methylsulfanylpyridin-2-amine is CC.CSc1cccnc1N.
What is the InChIKey of ethane;3-methylsulfanylpyridin-2-amine?
The InChIKey is DECOFCFGMMUXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2S.C2H6/c1-9-5-3-2-4-8-6(5)7;1-2/h2-4H,1H3,(H2,7,8);1-2H3.
What are the key properties of ethane;3-methylsulfanylpyridin-2-amine?
ethane;3-methylsulfanylpyridin-2-amine has a molecular weight of 170.28 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methylsulfanylpyridin-2-amine is sourced from PubChem (CID 142810881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).