[4-(4-ethylphenoxy)-2-pyridinyl]methanamine

C14H16N2O — CID 62295885

IUPAC[4-(4-ethylphenoxy)-2-pyridinyl]methanamine
SMILESCCc1ccc(Oc2ccnc(CN)c2)cc1
InChIInChI=1S/C14H16N2O/c1-2-11-3-5-13(6-4-11)17-14-7-8-16-12(9-14)10-15/h3-9H,2,10,15H2,1H3
InChIKeyWRDGRGXVTIYOHM-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.89
Rot. Bonds4

About [4-(4-ethylphenoxy)-2-pyridinyl]methanamine

[4-(4-ethylphenoxy)-2-pyridinyl]methanamine (PubChem CID 62295885) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is [4-(4-ethylphenoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(4-ethylphenoxy)-2-pyridinyl]methanamine
PubChem CID62295885
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name[4-(4-ethylphenoxy)-2-pyridinyl]methanamine
SMILESCCc1ccc(Oc2ccnc(CN)c2)cc1
InChIInChI=1S/C14H16N2O/c1-2-11-3-5-13(6-4-11)17-14-7-8-16-12(9-14)10-15/h3-9H,2,10,15H2,1H3
InChIKeyWRDGRGXVTIYOHM-UHFFFAOYSA-N
XLogP2.89
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(4-ethylphenoxy)-2-pyridinyl]methanamine?
The IUPAC name of [4-(4-ethylphenoxy)-2-pyridinyl]methanamine (CID 62295885) is [4-(4-ethylphenoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [4-(4-ethylphenoxy)-2-pyridinyl]methanamine?
The canonical SMILES for [4-(4-ethylphenoxy)-2-pyridinyl]methanamine is CCc1ccc(Oc2ccnc(CN)c2)cc1.
What is the InChIKey of [4-(4-ethylphenoxy)-2-pyridinyl]methanamine?
The InChIKey is WRDGRGXVTIYOHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-2-11-3-5-13(6-4-11)17-14-7-8-16-12(9-14)10-15/h3-9H,2,10,15H2,1H3.
What are the key properties of [4-(4-ethylphenoxy)-2-pyridinyl]methanamine?
[4-(4-ethylphenoxy)-2-pyridinyl]methanamine has a molecular weight of 228.29 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-ethylphenoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 62295885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).