3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine

C11H17Cl2N3 — CID 102755864

IUPAC3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine
SMILESCNc1nc(N(C)CC(C)C)c(Cl)cc1Cl
InChIInChI=1S/C11H17Cl2N3/c1-7(2)6-16(4)11-9(13)5-8(12)10(14-3)15-11/h5,7H,6H2,1-4H3,(H,14,15)
InChIKeyVBMWMDRWRNQOFT-UHFFFAOYSA-N
MW262.18 g/mol
LogP3.52
Rot. Bonds4

About 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine

3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine (PubChem CID 102755864) has the molecular formula C11H17Cl2N3 and a molecular weight of 262.18 g/mol. Its IUPAC name is 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine
PubChem CID102755864
Molecular FormulaC11H17Cl2N3
Molecular Weight262.18 g/mol
Exact Mass261.08
IUPAC Name3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine
SMILESCNc1nc(N(C)CC(C)C)c(Cl)cc1Cl
InChIInChI=1S/C11H17Cl2N3/c1-7(2)6-16(4)11-9(13)5-8(12)10(14-3)15-11/h5,7H,6H2,1-4H3,(H,14,15)
InChIKeyVBMWMDRWRNQOFT-UHFFFAOYSA-N
XLogP3.52
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.18
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine?
The IUPAC name of 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine (CID 102755864) is 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine.
What is the SMILES notation for 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine?
The canonical SMILES for 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine is CNc1nc(N(C)CC(C)C)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine?
The InChIKey is VBMWMDRWRNQOFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17Cl2N3/c1-7(2)6-16(4)11-9(13)5-8(12)10(14-3)15-11/h5,7H,6H2,1-4H3,(H,14,15).
What are the key properties of 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine?
3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine has a molecular weight of 262.18 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2-N,6-N-dimethyl-6-N-(2-methylpropyl)pyridine-2,6-diamine is sourced from PubChem (CID 102755864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).