N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine

C14H14F2N2O — CID 63272898

IUPACN-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine
SMILESCCNCc1ccnc(Oc2cc(F)ccc2F)c1
InChIInChI=1S/C14H14F2N2O/c1-2-17-9-10-5-6-18-14(7-10)19-13-8-11(15)3-4-12(13)16/h3-8,17H,2,9H2,1H3
InChIKeyNXZFIZUGPGBPIS-UHFFFAOYSA-N
MW264.28 g/mol
LogP3.26
Rot. Bonds5

About N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine

N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine (PubChem CID 63272898) has the molecular formula C14H14F2N2O and a molecular weight of 264.28 g/mol. Its IUPAC name is N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine
PubChem CID63272898
Molecular FormulaC14H14F2N2O
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC NameN-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine
SMILESCCNCc1ccnc(Oc2cc(F)ccc2F)c1
InChIInChI=1S/C14H14F2N2O/c1-2-17-9-10-5-6-18-14(7-10)19-13-8-11(15)3-4-12(13)16/h3-8,17H,2,9H2,1H3
InChIKeyNXZFIZUGPGBPIS-UHFFFAOYSA-N
XLogP3.26
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(2,5-dichlorophenoxy)-4-pyridinyl]methyl]ethanamine
CID 62297790
N-[[2-(4-chloro-2-methylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 62321836
N-[[2-(2-chlorophenoxy)-4-pyridinyl]methyl]ethanamine
CID 62297828
N-[[2-(2,3-dimethylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 62297631
N-[[2-(3-bromo-5-fluorophenoxy)-4-pyridinyl]methyl]ethanamine
CID 81326230
N-[[2-(2-bromo-4-methoxyphenoxy)-4-pyridinyl]methyl]ethanamine
CID 104708297
N-[[6-(2,5-difluorophenoxy)-3-pyridinyl]methyl]propan-1-amine
CID 63273316
N-[[2-(2-methyl-5-propan-2-ylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 62323489
N-[[2-(4-bromo-2-propan-2-ylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 115402661
N-[[2-(3-chloro-2-fluorophenoxy)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 116689946
4-(chloromethyl)-2-(2,4-difluorophenoxy)pyridine
CID 61267682
N-[[2-(3-bromo-4-fluorophenoxy)-4-pyridinyl]methyl]propan-1-amine
CID 83234738

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine (CID 63272898) is N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine is CCNCc1ccnc(Oc2cc(F)ccc2F)c1.
What is the InChIKey of N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine?
The InChIKey is NXZFIZUGPGBPIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c1-2-17-9-10-5-6-18-14(7-10)19-13-8-11(15)3-4-12(13)16/h3-8,17H,2,9H2,1H3.
What are the key properties of N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine?
N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine has a molecular weight of 264.28 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,5-difluorophenoxy)-4-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 63272898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).