6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine

C11H19N3O — CID 79827803

IUPAC6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine
SMILESCC(C)CC(C)Oc1ccc(N)c(N)n1
InChIInChI=1S/C11H19N3O/c1-7(2)6-8(3)15-10-5-4-9(12)11(13)14-10/h4-5,7-8H,6,12H2,1-3H3,(H2,13,14)
InChIKeyABRXCYDMXKFSCT-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.06
Rot. Bonds4

About 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine

6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine (PubChem CID 79827803) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine
PubChem CID79827803
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine
SMILESCC(C)CC(C)Oc1ccc(N)c(N)n1
InChIInChI=1S/C11H19N3O/c1-7(2)6-8(3)15-10-5-4-9(12)11(13)14-10/h4-5,7-8H,6,12H2,1-3H3,(H2,13,14)
InChIKeyABRXCYDMXKFSCT-UHFFFAOYSA-N
XLogP2.06
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine 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-methylpentan-2-yloxy)pyridine-2,3-diamine?
The IUPAC name of 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine (CID 79827803) is 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine.
What is the SMILES notation for 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine?
The canonical SMILES for 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine is CC(C)CC(C)Oc1ccc(N)c(N)n1.
What is the InChIKey of 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine?
The InChIKey is ABRXCYDMXKFSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-7(2)6-8(3)15-10-5-4-9(12)11(13)14-10/h4-5,7-8H,6,12H2,1-3H3,(H2,13,14).
What are the key properties of 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine?
6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine has a molecular weight of 209.29 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylpentan-2-yloxy)pyridine-2,3-diamine is sourced from PubChem (CID 79827803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).