2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine

C14H25N3O — CID 43587823

IUPAC2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine
SMILESCCC(CC)CN(CC)c1ccc(N)c(OC)n1
InChIInChI=1S/C14H25N3O/c1-5-11(6-2)10-17(7-3)13-9-8-12(15)14(16-13)18-4/h8-9,11H,5-7,10,15H2,1-4H3
InChIKeyPSBILLAEGZATLL-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.93
Rot. Bonds7

About 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine

2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine (PubChem CID 43587823) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine
PubChem CID43587823
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine
SMILESCCC(CC)CN(CC)c1ccc(N)c(OC)n1
InChIInChI=1S/C14H25N3O/c1-5-11(6-2)10-17(7-3)13-9-8-12(15)14(16-13)18-4/h8-9,11H,5-7,10,15H2,1-4H3
InChIKeyPSBILLAEGZATLL-UHFFFAOYSA-N
XLogP2.93
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine?
The IUPAC name of 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine (CID 43587823) is 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine.
What is the SMILES notation for 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine?
The canonical SMILES for 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine is CCC(CC)CN(CC)c1ccc(N)c(OC)n1.
What is the InChIKey of 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine?
The InChIKey is PSBILLAEGZATLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-5-11(6-2)10-17(7-3)13-9-8-12(15)14(16-13)18-4/h8-9,11H,5-7,10,15H2,1-4H3.
What are the key properties of 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine?
2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine has a molecular weight of 251.37 g/mol, XLogP of 2.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-2-N-(2-ethylbutyl)-6-methoxypyridine-2,5-diamine is sourced from PubChem (CID 43587823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).