[2-(1-pyridin-4-ylethoxy)phenyl]methanamine

C14H16N2O — CID 82037250

IUPAC[2-(1-pyridin-4-ylethoxy)phenyl]methanamine
SMILESCC(Oc1ccccc1CN)c1ccncc1
InChIInChI=1S/C14H16N2O/c1-11(12-6-8-16-9-7-12)17-14-5-3-2-4-13(14)10-15/h2-9,11H,10,15H2,1H3
InChIKeyNWJUADDTKLHRMF-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.68
Rot. Bonds4

About [2-(1-pyridin-4-ylethoxy)phenyl]methanamine

[2-(1-pyridin-4-ylethoxy)phenyl]methanamine (PubChem CID 82037250) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is [2-(1-pyridin-4-ylethoxy)phenyl]methanamine.

Molecular Properties

Compound Name[2-(1-pyridin-4-ylethoxy)phenyl]methanamine
PubChem CID82037250
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name[2-(1-pyridin-4-ylethoxy)phenyl]methanamine
SMILESCC(Oc1ccccc1CN)c1ccncc1
InChIInChI=1S/C14H16N2O/c1-11(12-6-8-16-9-7-12)17-14-5-3-2-4-13(14)10-15/h2-9,11H,10,15H2,1H3
InChIKeyNWJUADDTKLHRMF-UHFFFAOYSA-N
XLogP2.68
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[1-(1-methylimidazol-2-yl)ethoxy]phenyl]methanamine
CID 117052114
[2-[1-(1H-pyrrol-2-yl)ethoxy]phenyl]methanamine
CID 117052101
5-(1-pyridin-4-ylethoxy)naphthalen-1-amine
CID 82037865
4-[1-(2-ethylphenoxy)ethyl]aniline
CID 61261291
2-[2-(1-phenylethoxy)phenyl]ethanol
CID 107713134
O-(1-pyridin-4-ylethyl)hydroxylamine
CID 102548796
2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine
CID 82037470
2-(2-propan-2-yloxyphenyl)ethanamine
CID 22379502
1-[2-(aminomethyl)phenoxy]propan-2-ol;hydrochloride
CID 54594731
2-[2-[(1S)-1-[3-[3-(aminomethyl)phenyl]phenyl]ethoxy]phenyl]acetic acid
CID 125465818
2-[2-(aminomethyl)phenoxy]-N-(methylcarbamoyl)propanamide
CID 43115833
4-[1-(3-ethylphenoxy)ethyl]pyridine
CID 70911027

Frequently Asked Questions

What is the IUPAC name of [2-(1-pyridin-4-ylethoxy)phenyl]methanamine?
The IUPAC name of [2-(1-pyridin-4-ylethoxy)phenyl]methanamine (CID 82037250) is [2-(1-pyridin-4-ylethoxy)phenyl]methanamine.
What is the SMILES notation for [2-(1-pyridin-4-ylethoxy)phenyl]methanamine?
The canonical SMILES for [2-(1-pyridin-4-ylethoxy)phenyl]methanamine is CC(Oc1ccccc1CN)c1ccncc1.
What is the InChIKey of [2-(1-pyridin-4-ylethoxy)phenyl]methanamine?
The InChIKey is NWJUADDTKLHRMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-11(12-6-8-16-9-7-12)17-14-5-3-2-4-13(14)10-15/h2-9,11H,10,15H2,1H3.
What are the key properties of [2-(1-pyridin-4-ylethoxy)phenyl]methanamine?
[2-(1-pyridin-4-ylethoxy)phenyl]methanamine has a molecular weight of 228.30 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-pyridin-4-ylethoxy)phenyl]methanamine is sourced from PubChem (CID 82037250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).