2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine

C13H21N3O — CID 134789510

IUPAC2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine
SMILESCC(CN)(CN1CCOCC1)c1ccccn1
InChIInChI=1S/C13H21N3O/c1-13(10-14,12-4-2-3-5-15-12)11-16-6-8-17-9-7-16/h2-5H,6-11,14H2,1H3
InChIKeyWYRGGXBIYVCDLE-UHFFFAOYSA-N
MW235.33 g/mol
LogP0.63
Rot. Bonds4

About 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine

2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine (PubChem CID 134789510) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine
PubChem CID134789510
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine
SMILESCC(CN)(CN1CCOCC1)c1ccccn1
InChIInChI=1S/C13H21N3O/c1-13(10-14,12-4-2-3-5-15-12)11-16-6-8-17-9-7-16/h2-5H,6-11,14H2,1H3
InChIKeyWYRGGXBIYVCDLE-UHFFFAOYSA-N
XLogP0.63
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine?
The IUPAC name of 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine (CID 134789510) is 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine is CC(CN)(CN1CCOCC1)c1ccccn1.
What is the InChIKey of 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine?
The InChIKey is WYRGGXBIYVCDLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-13(10-14,12-4-2-3-5-15-12)11-16-6-8-17-9-7-16/h2-5H,6-11,14H2,1H3.
What are the key properties of 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine?
2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine has a molecular weight of 235.33 g/mol, XLogP of 0.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-morpholin-4-yl-2-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 134789510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).