6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine

C12H20N2O — CID 42625538

IUPAC6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine
SMILESCOCCC(C)Cc1cc(C)cc(N)n1
InChIInChI=1S/C12H20N2O/c1-9(4-5-15-3)6-11-7-10(2)8-12(13)14-11/h7-9H,4-6H2,1-3H3,(H2,13,14)
InChIKeyVQQIZVJSKCUKHT-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.19
Rot. Bonds5

About 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine

6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine (PubChem CID 42625538) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine.

Molecular Properties

Compound Name6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine
PubChem CID42625538
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine
SMILESCOCCC(C)Cc1cc(C)cc(N)n1
InChIInChI=1S/C12H20N2O/c1-9(4-5-15-3)6-11-7-10(2)8-12(13)14-11/h7-9H,4-6H2,1-3H3,(H2,13,14)
InChIKeyVQQIZVJSKCUKHT-UHFFFAOYSA-N
XLogP2.19
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-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-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine?
The IUPAC name of 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine (CID 42625538) is 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine.
What is the SMILES notation for 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine?
The canonical SMILES for 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine is COCCC(C)Cc1cc(C)cc(N)n1.
What is the InChIKey of 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine?
The InChIKey is VQQIZVJSKCUKHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-9(4-5-15-3)6-11-7-10(2)8-12(13)14-11/h7-9H,4-6H2,1-3H3,(H2,13,14).
What are the key properties of 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine?
6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine has a molecular weight of 208.30 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxy-2-methylbutyl)-4-methylpyridin-2-amine is sourced from PubChem (CID 42625538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).