3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine

C11H19N3O — CID 79198235

IUPAC3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine
SMILESCOC(C)(C)C(N)c1cc(C)cnc1N
InChIInChI=1S/C11H19N3O/c1-7-5-8(10(13)14-6-7)9(12)11(2,3)15-4/h5-6,9H,12H2,1-4H3,(H2,13,14)
InChIKeyQIUIYXURFLEEIV-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.40
Rot. Bonds3

About 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine

3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine (PubChem CID 79198235) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine
PubChem CID79198235
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine
SMILESCOC(C)(C)C(N)c1cc(C)cnc1N
InChIInChI=1S/C11H19N3O/c1-7-5-8(10(13)14-6-7)9(12)11(2,3)15-4/h5-6,9H,12H2,1-4H3,(H2,13,14)
InChIKeyQIUIYXURFLEEIV-UHFFFAOYSA-N
XLogP1.40
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine?
The IUPAC name of 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine (CID 79198235) is 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine.
What is the SMILES notation for 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine?
The canonical SMILES for 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine is COC(C)(C)C(N)c1cc(C)cnc1N.
What is the InChIKey of 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine?
The InChIKey is QIUIYXURFLEEIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-7-5-8(10(13)14-6-7)9(12)11(2,3)15-4/h5-6,9H,12H2,1-4H3,(H2,13,14).
What are the key properties of 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine?
3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine has a molecular weight of 209.29 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine is sourced from PubChem (CID 79198235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).