6-methyl-3-methylsulfanyl-3,4-dihydropyridine

C7H11NS — CID 143707893

IUPAC6-methyl-3-methylsulfanyl-3,4-dihydropyridine
SMILESCSC1C=NC(C)=CC1
InChIInChI=1S/C7H11NS/c1-6-3-4-7(9-2)5-8-6/h3,5,7H,4H2,1-2H3
InChIKeyFWNITMNLGWRESQ-UHFFFAOYSA-N
MW141.24 g/mol
LogP2.10
Rot. Bonds1

About 6-methyl-3-methylsulfanyl-3,4-dihydropyridine

6-methyl-3-methylsulfanyl-3,4-dihydropyridine (PubChem CID 143707893) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is 6-methyl-3-methylsulfanyl-3,4-dihydropyridine.

Molecular Properties

Compound Name6-methyl-3-methylsulfanyl-3,4-dihydropyridine
PubChem CID143707893
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC Name6-methyl-3-methylsulfanyl-3,4-dihydropyridine
SMILESCSC1C=NC(C)=CC1
InChIInChI=1S/C7H11NS/c1-6-3-4-7(9-2)5-8-6/h3,5,7H,4H2,1-2H3
InChIKeyFWNITMNLGWRESQ-UHFFFAOYSA-N
XLogP2.10
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4(3H)-Pyridinethione, 6-methyl-
CID 17769747
6-ethyl-3H-pyridine-4-thione
CID 17996044
4-Methylsulfanyl-2,5-dihydropyridine
CID 57165473
2-Methyl-3-methylsulfanyl-2,5-dihydropyridine
CID 57325034
6-Methyl-2,4-bis(methylsulfanyl)-3,4-dihydropyridine
CID 59897658
2-(Methylsulfanylmethyl)-2,3-dihydropyridine
CID 70055439
N-[(E)-5-methylsulfanyloct-3-en-4-yl]ethanimine
CID 130281263
(Z)-4-(propylideneamino)pent-3-ene-2-thiol
CID 145702456
6-Ethyl-3-methylsulfonyl-3,4-dihydropyridine
CID 163689115

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-methylsulfanyl-3,4-dihydropyridine?
The IUPAC name of 6-methyl-3-methylsulfanyl-3,4-dihydropyridine (CID 143707893) is 6-methyl-3-methylsulfanyl-3,4-dihydropyridine.
What is the SMILES notation for 6-methyl-3-methylsulfanyl-3,4-dihydropyridine?
The canonical SMILES for 6-methyl-3-methylsulfanyl-3,4-dihydropyridine is CSC1C=NC(C)=CC1.
What is the InChIKey of 6-methyl-3-methylsulfanyl-3,4-dihydropyridine?
The InChIKey is FWNITMNLGWRESQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NS/c1-6-3-4-7(9-2)5-8-6/h3,5,7H,4H2,1-2H3.
What are the key properties of 6-methyl-3-methylsulfanyl-3,4-dihydropyridine?
6-methyl-3-methylsulfanyl-3,4-dihydropyridine has a molecular weight of 141.24 g/mol, XLogP of 2.10, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-methylsulfanyl-3,4-dihydropyridine is sourced from PubChem (CID 143707893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).