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

C15H23Cl2N3 — CID 102759574

IUPAC3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine
SMILESCC1(C)CC(Nc2nc(N)c(Cl)cc2Cl)CC(C)(C)C1
InChIInChI=1S/C15H23Cl2N3/c1-14(2)6-9(7-15(3,4)8-14)19-13-11(17)5-10(16)12(18)20-13/h5,9H,6-8H2,1-4H3,(H3,18,19,20)
InChIKeyZGADYRCRGHJKLT-UHFFFAOYSA-N
MW316.28 g/mol
LogP4.99
Rot. Bonds2

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

3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine (PubChem CID 102759574) has the molecular formula C15H23Cl2N3 and a molecular weight of 316.28 g/mol. Its IUPAC name is 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine
PubChem CID102759574
Molecular FormulaC15H23Cl2N3
Molecular Weight316.28 g/mol
Exact Mass315.13
IUPAC Name3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine
SMILESCC1(C)CC(Nc2nc(N)c(Cl)cc2Cl)CC(C)(C)C1
InChIInChI=1S/C15H23Cl2N3/c1-14(2)6-9(7-15(3,4)8-14)19-13-11(17)5-10(16)12(18)20-13/h5,9H,6-8H2,1-4H3,(H3,18,19,20)
InChIKeyZGADYRCRGHJKLT-UHFFFAOYSA-N
XLogP4.99
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.28
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5,6-trichloro-N-(3,3,5,5-tetramethylcyclohexyl)pyridin-2-amine
CID 102751760
6-chloro-2-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,3-diamine
CID 103965270
6-chloro-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,5-diamine
CID 103965332
3,5-dichloro-6-N-(3-methylsulfanylcyclopentyl)pyridine-2,6-diamine
CID 114124115
3,5-dichloro-6-N-(1-methylcyclopropyl)pyridine-2,6-diamine
CID 102759897
6-N-(1-adamantyl)-3,5-dichloropyridine-2,6-diamine
CID 102754866
3-chloro-N-(3,3,5,5-tetramethylcyclohexyl)pyrazin-2-amine
CID 103968163
3,5-dichloro-6-N-ethylpyridine-2,6-diamine
CID 102755516
3,5-dichloro-6-N-(3,3-dimethylcyclohexyl)-2-N-ethylpyridine-2,6-diamine
CID 102759264
3,5-dichloro-6-N-(2,3-dimethylcyclohexyl)pyridine-2,6-diamine
CID 102755663
2,4-dichloro-N-(3,3,5,5-tetramethylcyclohexyl)aniline
CID 112681827
2-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-2,5-diamine
CID 103965308

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine?
The IUPAC name of 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine (CID 102759574) is 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine.
What is the SMILES notation for 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine?
The canonical SMILES for 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine is CC1(C)CC(Nc2nc(N)c(Cl)cc2Cl)CC(C)(C)C1.
What is the InChIKey of 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine?
The InChIKey is ZGADYRCRGHJKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23Cl2N3/c1-14(2)6-9(7-15(3,4)8-14)19-13-11(17)5-10(16)12(18)20-13/h5,9H,6-8H2,1-4H3,(H3,18,19,20).
What are the key properties of 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine?
3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine has a molecular weight of 316.28 g/mol, XLogP of 4.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,6-diamine is sourced from PubChem (CID 102759574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).