2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine

C14H25N3O — CID 114004558

IUPAC2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine
SMILESCCCCC(CC)CNc1nc(OC)ccc1N
InChIInChI=1S/C14H25N3O/c1-4-6-7-11(5-2)10-16-14-12(15)8-9-13(17-14)18-3/h8-9,11H,4-7,10,15H2,1-3H3,(H,16,17)
InChIKeyHVVDJUIUDPGTPB-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.30
Rot. Bonds8

About 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine

2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine (PubChem CID 114004558) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine
PubChem CID114004558
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine
SMILESCCCCC(CC)CNc1nc(OC)ccc1N
InChIInChI=1S/C14H25N3O/c1-4-6-7-11(5-2)10-16-14-12(15)8-9-13(17-14)18-3/h8-9,11H,4-7,10,15H2,1-3H3,(H,16,17)
InChIKeyHVVDJUIUDPGTPB-UHFFFAOYSA-N
XLogP3.30
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-butyl-6-methoxypyridine-2,3-diamine
CID 115320288
2-N-(2-ethylhexyl)-6-propoxypyridine-2,5-diamine
CID 107819858
N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine
CID 107816517
1-N-(2-ethylhexyl)-4-methoxybenzene-1,2-diamine
CID 107819851
4-N-(2-ethylhexyl)-2-methylbenzene-1,4-diamine
CID 107819815
5-chloro-N-(2-ethylhexyl)-2-methoxypyrimidin-4-amine
CID 107816615
2-[(3-amino-6-methoxy-2-pyridinyl)amino]ethanol;dihydrochloride
CID 3019251
methyl 3-amino-2-(2-ethylhexylamino)pyridine-4-carboxylate
CID 107817832
6-methoxy-2-N-[(4-methoxyphenyl)methyl]pyridine-2,3-diamine
CID 115320291
6-methoxy-2-N-(2-methylprop-2-enyl)pyridine-2,3-diamine
CID 114615186
4-bromo-2-N-(2-ethylhexyl)benzene-1,2-diamine
CID 114004564
6-bromo-2-N-(2-ethylhexyl)pyrimidine-2,4-diamine
CID 114004473

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine?
The IUPAC name of 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine (CID 114004558) is 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine.
What is the SMILES notation for 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine?
The canonical SMILES for 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine is CCCCC(CC)CNc1nc(OC)ccc1N.
What is the InChIKey of 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine?
The InChIKey is HVVDJUIUDPGTPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-4-6-7-11(5-2)10-16-14-12(15)8-9-13(17-14)18-3/h8-9,11H,4-7,10,15H2,1-3H3,(H,16,17).
What are the key properties of 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine?
2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine has a molecular weight of 251.37 g/mol, XLogP of 3.30, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine is sourced from PubChem (CID 114004558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).