4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine

C14H17N3 — CID 135201746

IUPAC4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine
SMILESCCc1cc(N)nc(Nc2ccc(C)cc2)c1
InChIInChI=1S/C14H17N3/c1-3-11-8-13(15)17-14(9-11)16-12-6-4-10(2)5-7-12/h4-9H,3H2,1-2H3,(H3,15,16,17)
InChIKeyDMAOZBDTEFQCSX-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.28
Rot. Bonds3

About 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine

4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine (PubChem CID 135201746) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine
PubChem CID135201746
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine
SMILESCCc1cc(N)nc(Nc2ccc(C)cc2)c1
InChIInChI=1S/C14H17N3/c1-3-11-8-13(15)17-14(9-11)16-12-6-4-10(2)5-7-12/h4-9H,3H2,1-2H3,(H3,15,16,17)
InChIKeyDMAOZBDTEFQCSX-UHFFFAOYSA-N
XLogP3.28
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine?
The IUPAC name of 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine (CID 135201746) is 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine.
What is the SMILES notation for 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine?
The canonical SMILES for 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine is CCc1cc(N)nc(Nc2ccc(C)cc2)c1.
What is the InChIKey of 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine?
The InChIKey is DMAOZBDTEFQCSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-3-11-8-13(15)17-14(9-11)16-12-6-4-10(2)5-7-12/h4-9H,3H2,1-2H3,(H3,15,16,17).
What are the key properties of 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine?
4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine has a molecular weight of 227.31 g/mol, XLogP of 3.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-N-(4-methylphenyl)pyridine-2,6-diamine is sourced from PubChem (CID 135201746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).