2-(2-phenoxy-4-pyridinyl)ethanamine

C13H14N2O — CID 154870139

IUPAC2-(2-phenoxy-4-pyridinyl)ethanamine
SMILESNCCc1ccnc(Oc2ccccc2)c1
InChIInChI=1S/C13H14N2O/c14-8-6-11-7-9-15-13(10-11)16-12-4-2-1-3-5-12/h1-5,7,9-10H,6,8,14H2
InChIKeySEKWHNBLHUGYGF-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.38
Rot. Bonds4

About 2-(2-phenoxy-4-pyridinyl)ethanamine

2-(2-phenoxy-4-pyridinyl)ethanamine (PubChem CID 154870139) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 2-(2-phenoxy-4-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(2-phenoxy-4-pyridinyl)ethanamine
PubChem CID154870139
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name2-(2-phenoxy-4-pyridinyl)ethanamine
SMILESNCCc1ccnc(Oc2ccccc2)c1
InChIInChI=1S/C13H14N2O/c14-8-6-11-7-9-15-13(10-11)16-12-4-2-1-3-5-12/h1-5,7,9-10H,6,8,14H2
InChIKeySEKWHNBLHUGYGF-UHFFFAOYSA-N
XLogP2.38
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxy-4-pyridinyl)ethanamine?
The IUPAC name of 2-(2-phenoxy-4-pyridinyl)ethanamine (CID 154870139) is 2-(2-phenoxy-4-pyridinyl)ethanamine.
What is the SMILES notation for 2-(2-phenoxy-4-pyridinyl)ethanamine?
The canonical SMILES for 2-(2-phenoxy-4-pyridinyl)ethanamine is NCCc1ccnc(Oc2ccccc2)c1.
What is the InChIKey of 2-(2-phenoxy-4-pyridinyl)ethanamine?
The InChIKey is SEKWHNBLHUGYGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c14-8-6-11-7-9-15-13(10-11)16-12-4-2-1-3-5-12/h1-5,7,9-10H,6,8,14H2.
What are the key properties of 2-(2-phenoxy-4-pyridinyl)ethanamine?
2-(2-phenoxy-4-pyridinyl)ethanamine has a molecular weight of 214.27 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxy-4-pyridinyl)ethanamine is sourced from PubChem (CID 154870139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).