3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine

C10H8Cl2N2S — CID 102753544

IUPAC3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine
SMILESCc1ccc(-c2nc(N)c(Cl)cc2Cl)s1
InChIInChI=1S/C10H8Cl2N2S/c1-5-2-3-8(15-5)9-6(11)4-7(12)10(13)14-9/h2-4H,1H3,(H2,13,14)
InChIKeyQBDGPUCFMAKWRY-UHFFFAOYSA-N
MW259.16 g/mol
LogP4.01
Rot. Bonds1

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

3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine (PubChem CID 102753544) has the molecular formula C10H8Cl2N2S and a molecular weight of 259.16 g/mol. Its IUPAC name is 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine
PubChem CID102753544
Molecular FormulaC10H8Cl2N2S
Molecular Weight259.16 g/mol
Exact Mass257.98
IUPAC Name3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine
SMILESCc1ccc(-c2nc(N)c(Cl)cc2Cl)s1
InChIInChI=1S/C10H8Cl2N2S/c1-5-2-3-8(15-5)9-6(11)4-7(12)10(13)14-9/h2-4H,1H3,(H2,13,14)
InChIKeyQBDGPUCFMAKWRY-UHFFFAOYSA-N
XLogP4.01
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.16
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine (CID 102753544) is 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine is Cc1ccc(-c2nc(N)c(Cl)cc2Cl)s1.
What is the InChIKey of 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine?
The InChIKey is QBDGPUCFMAKWRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2S/c1-5-2-3-8(15-5)9-6(11)4-7(12)10(13)14-9/h2-4H,1H3,(H2,13,14).
What are the key properties of 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine?
3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine has a molecular weight of 259.16 g/mol, XLogP of 4.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(5-methylthiophen-2-yl)pyridin-2-amine is sourced from PubChem (CID 102753544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).