[5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine

C14H16N2O2 — CID 113469599

IUPAC[5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine
SMILESCCOc1cccc(Oc2cncc(CN)c2)c1
InChIInChI=1S/C14H16N2O2/c1-2-17-12-4-3-5-13(7-12)18-14-6-11(8-15)9-16-10-14/h3-7,9-10H,2,8,15H2,1H3
InChIKeyOJZHIRQZJBOVTO-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.73
Rot. Bonds5

About [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine

[5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine (PubChem CID 113469599) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine
PubChem CID113469599
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name[5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine
SMILESCCOc1cccc(Oc2cncc(CN)c2)c1
InChIInChI=1S/C14H16N2O2/c1-2-17-12-4-3-5-13(7-12)18-14-6-11(8-15)9-16-10-14/h3-7,9-10H,2,8,15H2,1H3
InChIKeyOJZHIRQZJBOVTO-UHFFFAOYSA-N
XLogP2.73
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(4-ethoxyphenoxy)phenyl]methanamine
CID 58104515
6-(3-ethoxyphenoxy)pyrazin-2-amine
CID 80647483
2-(3-ethoxyphenoxy)pyrimidin-5-amine
CID 55060800
2-[3-(4-ethoxyphenoxy)phenyl]ethanamine
CID 63941757
[5-(3-chloro-4-fluorophenoxy)-3-pyridinyl]methanamine
CID 113469610
[5-(3-ethoxyphenoxy)-1,3,4-thiadiazol-2-yl]methanamine
CID 80620950
2-chloro-6-(3-ethoxyphenoxy)pyrazine
CID 55061194
4-(3-ethoxyphenoxy)benzenecarbothioamide
CID 62338264
3-ethoxy-5-pyridin-3-yloxyaniline
CID 80748740
1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol
CID 83124813
3-(3-ethoxyphenoxy)-5-methoxyaniline
CID 80748304
[4-(aminomethyl)phenyl]-(5-ethoxy-3-pyridinyl)methanone
CID 116548333

Frequently Asked Questions

What is the IUPAC name of [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine?
The IUPAC name of [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine (CID 113469599) is [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine is CCOc1cccc(Oc2cncc(CN)c2)c1.
What is the InChIKey of [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine?
The InChIKey is OJZHIRQZJBOVTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-2-17-12-4-3-5-13(7-12)18-14-6-11(8-15)9-16-10-14/h3-7,9-10H,2,8,15H2,1H3.
What are the key properties of [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine?
[5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine has a molecular weight of 244.29 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 113469599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).