5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane

C9H14Cl2N2 — CID 156715440

IUPAC5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane
SMILESCC.Cc1nc(Cl)c(Cl)c(C)c1N
InChIInChI=1S/C7H8Cl2N2.C2H6/c1-3-5(8)7(9)11-4(2)6(3)10;1-2/h10H2,1-2H3;1-2H3
InChIKeyVRYLCNXKTIBFFK-UHFFFAOYSA-N
MW221.13 g/mol
LogP3.61
Rot. Bonds

About 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane

5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane (PubChem CID 156715440) has the molecular formula C9H14Cl2N2 and a molecular weight of 221.13 g/mol. Its IUPAC name is 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane.

Molecular Properties

Compound Name5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane
PubChem CID156715440
Molecular FormulaC9H14Cl2N2
Molecular Weight221.13 g/mol
Exact Mass220.05
IUPAC Name5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane
SMILESCC.Cc1nc(Cl)c(Cl)c(C)c1N
InChIInChI=1S/C7H8Cl2N2.C2H6/c1-3-5(8)7(9)11-4(2)6(3)10;1-2/h10H2,1-2H3;1-2H3
InChIKeyVRYLCNXKTIBFFK-UHFFFAOYSA-N
XLogP3.61
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.13
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane?
The IUPAC name of 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane (CID 156715440) is 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane.
What is the SMILES notation for 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane?
The canonical SMILES for 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane is CC.Cc1nc(Cl)c(Cl)c(C)c1N.
What is the InChIKey of 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane?
The InChIKey is VRYLCNXKTIBFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8Cl2N2.C2H6/c1-3-5(8)7(9)11-4(2)6(3)10;1-2/h10H2,1-2H3;1-2H3.
What are the key properties of 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane?
5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane has a molecular weight of 221.13 g/mol, XLogP of 3.61, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane is sourced from PubChem (CID 156715440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).