3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine

C10H14Cl2N2S — CID 107765860

IUPAC3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine
SMILESCC(C)CCSc1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C10H14Cl2N2S/c1-6(2)3-4-15-10-8(12)5-7(11)9(13)14-10/h5-6H,3-4H2,1-2H3,(H2,13,14)
InChIKeyIZQOHWDXGTXWPS-UHFFFAOYSA-N
MW265.21 g/mol
LogP4.11
Rot. Bonds4

About 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine

3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine (PubChem CID 107765860) has the molecular formula C10H14Cl2N2S and a molecular weight of 265.21 g/mol. Its IUPAC name is 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine
PubChem CID107765860
Molecular FormulaC10H14Cl2N2S
Molecular Weight265.21 g/mol
Exact Mass264.03
IUPAC Name3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine
SMILESCC(C)CCSc1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C10H14Cl2N2S/c1-6(2)3-4-15-10-8(12)5-7(11)9(13)14-10/h5-6H,3-4H2,1-2H3,(H2,13,14)
InChIKeyIZQOHWDXGTXWPS-UHFFFAOYSA-N
XLogP4.11
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.21
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-N-methyl-6-(3-methylbutylsulfanyl)pyridin-2-amine
CID 107765930
3,5-dichloro-6-methylsulfanylpyridin-2-amine
CID 102761414
4-chloro-6-(3-methylbutylsulfanyl)pyrimidin-2-amine
CID 103704699
3,5-dichloro-6-(2-methylpropyl)pyridin-2-amine
CID 102753366
3,5-dichloro-6-N-(4-methylpentyl)pyridine-2,6-diamine
CID 102758112
2,4-dichloro-6-(3-methylbutylsulfanyl)-1,3,5-triazine
CID 107751337
6-methyl-2-(3-methylbutylsulfanyl)pyridin-3-amine
CID 107748105
3,5-dichloro-6-(2-chlorophenyl)sulfanylpyridin-2-amine
CID 102761364
6-methyl-4-(3-methylbutylsulfanyl)thieno[2,3-d]pyrimidin-2-amine
CID 107765903
2-chloro-6-methyl-4-(3-methylbutylsulfanyl)thieno[2,3-d]pyrimidine
CID 107751336
6-methoxy-2-(3-methylbutylsulfanyl)pyridin-3-amine
CID 107748191
2,3,5-trichloro-6-ethylsulfanylpyridine
CID 102752225

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine (CID 107765860) is 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine is CC(C)CCSc1nc(N)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine?
The InChIKey is IZQOHWDXGTXWPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N2S/c1-6(2)3-4-15-10-8(12)5-7(11)9(13)14-10/h5-6H,3-4H2,1-2H3,(H2,13,14).
What are the key properties of 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine?
3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine has a molecular weight of 265.21 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(3-methylbutylsulfanyl)pyridin-2-amine is sourced from PubChem (CID 107765860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).