6-N-(7-methyloctyl)pyridine-2,6-diamine

C14H25N3 — CID 114004472

IUPAC6-N-(7-methyloctyl)pyridine-2,6-diamine
SMILESCC(C)CCCCCCNc1cccc(N)n1
InChIInChI=1S/C14H25N3/c1-12(2)8-5-3-4-6-11-16-14-10-7-9-13(15)17-14/h7,9-10,12H,3-6,8,11H2,1-2H3,(H3,15,16,17)
InChIKeyFLJRIQKHHJDKMQ-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.68
Rot. Bonds8

About 6-N-(7-methyloctyl)pyridine-2,6-diamine

6-N-(7-methyloctyl)pyridine-2,6-diamine (PubChem CID 114004472) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 6-N-(7-methyloctyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(7-methyloctyl)pyridine-2,6-diamine
PubChem CID114004472
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name6-N-(7-methyloctyl)pyridine-2,6-diamine
SMILESCC(C)CCCCCCNc1cccc(N)n1
InChIInChI=1S/C14H25N3/c1-12(2)8-5-3-4-6-11-16-14-10-7-9-13(15)17-14/h7,9-10,12H,3-6,8,11H2,1-2H3,(H3,15,16,17)
InChIKeyFLJRIQKHHJDKMQ-UHFFFAOYSA-N
XLogP3.68
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-N-(3-methylbutyl)pyridine-2,6-diamine
CID 80647498
6-methyl-N-(7-methyloctyl)pyridin-2-amine
CID 107816090
6-N-(7-methyloctyl)-2-N-propylpyridine-2,6-diamine
CID 107818930
6-chloro-N-(7-methyloctyl)pyridin-2-amine
CID 107817529
6-bromo-N-(5-methylhexyl)pyridin-2-amine
CID 115326764
4-[(6-amino-2-pyridinyl)amino]butan-1-ol
CID 106846869
6-N-[2-(methylamino)ethyl]pyridine-2,6-diamine
CID 10888283
6-N-(5-methylhexyl)pyridine-2,3,6-triamine
CID 115324674
6-methyl-2-N-(5-methylhexyl)pyridine-2,5-diamine
CID 115324773
6-N-(3-methoxypropyl)pyridine-2,6-diamine
CID 80647839
N-(7-methyloctyl)pyridazin-3-amine
CID 107816275
6-N-[2-[methyl(propan-2-yl)amino]ethyl]pyridine-2,6-diamine
CID 80646824

Frequently Asked Questions

What is the IUPAC name of 6-N-(7-methyloctyl)pyridine-2,6-diamine?
The IUPAC name of 6-N-(7-methyloctyl)pyridine-2,6-diamine (CID 114004472) is 6-N-(7-methyloctyl)pyridine-2,6-diamine.
What is the SMILES notation for 6-N-(7-methyloctyl)pyridine-2,6-diamine?
The canonical SMILES for 6-N-(7-methyloctyl)pyridine-2,6-diamine is CC(C)CCCCCCNc1cccc(N)n1.
What is the InChIKey of 6-N-(7-methyloctyl)pyridine-2,6-diamine?
The InChIKey is FLJRIQKHHJDKMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-12(2)8-5-3-4-6-11-16-14-10-7-9-13(15)17-14/h7,9-10,12H,3-6,8,11H2,1-2H3,(H3,15,16,17).
What are the key properties of 6-N-(7-methyloctyl)pyridine-2,6-diamine?
6-N-(7-methyloctyl)pyridine-2,6-diamine has a molecular weight of 235.37 g/mol, XLogP of 3.68, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(7-methyloctyl)pyridine-2,6-diamine is sourced from PubChem (CID 114004472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).