6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine

C14H23N3O — CID 104688787

IUPAC6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine
SMILESCCC1CCCCCN1c1ccc(N)c(OC)n1
InChIInChI=1S/C14H23N3O/c1-3-11-7-5-4-6-10-17(11)13-9-8-12(15)14(16-13)18-2/h8-9,11H,3-7,10,15H2,1-2H3
InChIKeyJPOANKYFCWRIED-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.83
Rot. Bonds3

About 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine

6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine (PubChem CID 104688787) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine.

Molecular Properties

Compound Name6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine
PubChem CID104688787
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine
SMILESCCC1CCCCCN1c1ccc(N)c(OC)n1
InChIInChI=1S/C14H23N3O/c1-3-11-7-5-4-6-10-17(11)13-9-8-12(15)14(16-13)18-2/h8-9,11H,3-7,10,15H2,1-2H3
InChIKeyJPOANKYFCWRIED-UHFFFAOYSA-N
XLogP2.83
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine?
The IUPAC name of 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine (CID 104688787) is 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine.
What is the SMILES notation for 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine?
The canonical SMILES for 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine is CCC1CCCCCN1c1ccc(N)c(OC)n1.
What is the InChIKey of 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine?
The InChIKey is JPOANKYFCWRIED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-11-7-5-4-6-10-17(11)13-9-8-12(15)14(16-13)18-2/h8-9,11H,3-7,10,15H2,1-2H3.
What are the key properties of 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine?
6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine has a molecular weight of 249.36 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine is sourced from PubChem (CID 104688787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).