6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine

C11H19N3O — CID 115486936

IUPAC6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine
SMILESCOCC(C)N(C)c1ccc(CN)nc1
InChIInChI=1S/C11H19N3O/c1-9(8-15-3)14(2)11-5-4-10(6-12)13-7-11/h4-5,7,9H,6,8,12H2,1-3H3
InChIKeyFDBGITUQHICASB-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.01
Rot. Bonds5

About 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine

6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine (PubChem CID 115486936) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine
PubChem CID115486936
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine
SMILESCOCC(C)N(C)c1ccc(CN)nc1
InChIInChI=1S/C11H19N3O/c1-9(8-15-3)14(2)11-5-4-10(6-12)13-7-11/h4-5,7,9H,6,8,12H2,1-3H3
InChIKeyFDBGITUQHICASB-UHFFFAOYSA-N
XLogP1.01
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine?
The IUPAC name of 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine (CID 115486936) is 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine.
What is the SMILES notation for 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine?
The canonical SMILES for 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine is COCC(C)N(C)c1ccc(CN)nc1.
What is the InChIKey of 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine?
The InChIKey is FDBGITUQHICASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9(8-15-3)14(2)11-5-4-10(6-12)13-7-11/h4-5,7,9H,6,8,12H2,1-3H3.
What are the key properties of 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine?
6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine has a molecular weight of 209.29 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine is sourced from PubChem (CID 115486936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).