3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine

C11H10Cl2N2OS — CID 102761283

IUPAC3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine
SMILESCNc1nc(SCc2ccco2)c(Cl)cc1Cl
InChIInChI=1S/C11H10Cl2N2OS/c1-14-10-8(12)5-9(13)11(15-10)17-6-7-3-2-4-16-7/h2-5H,6H2,1H3,(H,14,15)
InChIKeyQSNJTLMOGRUOOG-UHFFFAOYSA-N
MW289.19 g/mol
LogP4.32
Rot. Bonds4

About 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine

3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine (PubChem CID 102761283) has the molecular formula C11H10Cl2N2OS and a molecular weight of 289.19 g/mol. Its IUPAC name is 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine
PubChem CID102761283
Molecular FormulaC11H10Cl2N2OS
Molecular Weight289.19 g/mol
Exact Mass287.99
IUPAC Name3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine
SMILESCNc1nc(SCc2ccco2)c(Cl)cc1Cl
InChIInChI=1S/C11H10Cl2N2OS/c1-14-10-8(12)5-9(13)11(15-10)17-6-7-3-2-4-16-7/h2-5H,6H2,1H3,(H,14,15)
InChIKeyQSNJTLMOGRUOOG-UHFFFAOYSA-N
XLogP4.32
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.19
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3,5-trichloro-6-(furan-2-ylmethylsulfanyl)pyridine
CID 102752209
3,5-dichloro-N-methyl-6-[(2-methylphenyl)methylsulfanyl]pyridin-2-amine
CID 102761495
2-tert-butyl-6-(furan-2-ylmethylsulfanyl)-N,5-dimethylpyrimidin-4-amine
CID 80991282
5-chloro-N-ethyl-4-(furan-2-ylmethylsulfanyl)pyrimidin-2-amine
CID 80893486
3,5-dichloro-N-methyl-6-(3-methylbutylsulfanyl)pyridin-2-amine
CID 107765930
3,5-dichloro-6-(3,4-dichlorophenyl)sulfanyl-N-methylpyridin-2-amine
CID 102761528
4-(furan-2-ylmethylsulfanyl)-N,6-dimethylthieno[2,3-d]pyrimidin-2-amine
CID 103334041
3,5-dichloro-6-N-[2-(furan-2-yl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 102756901
1-[6-(furan-2-ylmethylsulfanyl)-5-methyl-3-pyridinyl]-N-methylmethanamine
CID 80639955
2-(furan-2-ylmethylsulfanyl)-4,6-dimethylpyridine-3-carbonitrile
CID 60658664
4-chloro-6-(furan-2-ylmethylsulfanyl)-2-methylsulfanylpyrimidine
CID 80545886
1-chloro-4-(furan-2-ylmethylsulfanyl)phthalazine
CID 62142545

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine (CID 102761283) is 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine is CNc1nc(SCc2ccco2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine?
The InChIKey is QSNJTLMOGRUOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2OS/c1-14-10-8(12)5-9(13)11(15-10)17-6-7-3-2-4-16-7/h2-5H,6H2,1H3,(H,14,15).
What are the key properties of 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine?
3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine has a molecular weight of 289.19 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(furan-2-ylmethylsulfanyl)-N-methylpyridin-2-amine is sourced from PubChem (CID 102761283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).