2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine

C14H23N3O — CID 124750899

IUPAC2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine
SMILESNCC[C@@H]1CN(CCCc2cccnc2)CCO1
InChIInChI=1S/C14H23N3O/c15-6-5-14-12-17(9-10-18-14)8-2-4-13-3-1-7-16-11-13/h1,3,7,11,14H,2,4-6,8-10,12,15H2/t14-/m1/s1
InChIKeyFEXPTXQPIWNNNX-CQSZACIVSA-N
MW249.36 g/mol
LogP1.06
Rot. Bonds6

About 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine

2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine (PubChem CID 124750899) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine
PubChem CID124750899
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine
SMILESNCC[C@@H]1CN(CCCc2cccnc2)CCO1
InChIInChI=1S/C14H23N3O/c15-6-5-14-12-17(9-10-18-14)8-2-4-13-3-1-7-16-11-13/h1,3,7,11,14H,2,4-6,8-10,12,15H2/t14-/m1/s1
InChIKeyFEXPTXQPIWNNNX-CQSZACIVSA-N
XLogP1.06
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine?
The IUPAC name of 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine (CID 124750899) is 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine.
What is the SMILES notation for 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine?
The canonical SMILES for 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine is NCC[C@@H]1CN(CCCc2cccnc2)CCO1.
What is the InChIKey of 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine?
The InChIKey is FEXPTXQPIWNNNX-CQSZACIVSA-N. The full InChI is InChI=1S/C14H23N3O/c15-6-5-14-12-17(9-10-18-14)8-2-4-13-3-1-7-16-11-13/h1,3,7,11,14H,2,4-6,8-10,12,15H2/t14-/m1/s1.
What are the key properties of 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine?
2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine has a molecular weight of 249.36 g/mol, XLogP of 1.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-4-(3-pyridin-3-ylpropyl)morpholin-2-yl]ethanamine is sourced from PubChem (CID 124750899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).