(2-phenoxy-4-pyridinyl)methanamine

C12H12N2O — CID 16785630

IUPAC(2-phenoxy-4-pyridinyl)methanamine
SMILESNCc1ccnc(Oc2ccccc2)c1
InChIInChI=1S/C12H12N2O/c13-9-10-6-7-14-12(8-10)15-11-4-2-1-3-5-11/h1-8H,9,13H2
InChIKeyPJFOUMAUWJEBRT-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.33
Rot. Bonds3

About (2-phenoxy-4-pyridinyl)methanamine

(2-phenoxy-4-pyridinyl)methanamine (PubChem CID 16785630) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is (2-phenoxy-4-pyridinyl)methanamine.

Molecular Properties

Compound Name(2-phenoxy-4-pyridinyl)methanamine
PubChem CID16785630
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name(2-phenoxy-4-pyridinyl)methanamine
SMILESNCc1ccnc(Oc2ccccc2)c1
InChIInChI=1S/C12H12N2O/c13-9-10-6-7-14-12(8-10)15-11-4-2-1-3-5-11/h1-8H,9,13H2
InChIKeyPJFOUMAUWJEBRT-UHFFFAOYSA-N
XLogP2.33
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-phenoxy-4-pyridinyl)methanamine?
The IUPAC name of (2-phenoxy-4-pyridinyl)methanamine (CID 16785630) is (2-phenoxy-4-pyridinyl)methanamine.
What is the SMILES notation for (2-phenoxy-4-pyridinyl)methanamine?
The canonical SMILES for (2-phenoxy-4-pyridinyl)methanamine is NCc1ccnc(Oc2ccccc2)c1.
What is the InChIKey of (2-phenoxy-4-pyridinyl)methanamine?
The InChIKey is PJFOUMAUWJEBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c13-9-10-6-7-14-12(8-10)15-11-4-2-1-3-5-11/h1-8H,9,13H2.
What are the key properties of (2-phenoxy-4-pyridinyl)methanamine?
(2-phenoxy-4-pyridinyl)methanamine has a molecular weight of 200.24 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenoxy-4-pyridinyl)methanamine is sourced from PubChem (CID 16785630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).