N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine

C14H14F2N2O — CID 62786202

IUPACN-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cc(Oc2cc(F)cc(F)c2)ccn1
InChIInChI=1S/C14H14F2N2O/c1-2-17-9-12-8-13(3-4-18-12)19-14-6-10(15)5-11(16)7-14/h3-8,17H,2,9H2,1H3
InChIKeyRQBXPSPAXYQLFW-UHFFFAOYSA-N
MW264.28 g/mol
LogP3.26
Rot. Bonds5

About N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine

N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine (PubChem CID 62786202) has the molecular formula C14H14F2N2O and a molecular weight of 264.28 g/mol. Its IUPAC name is N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine
PubChem CID62786202
Molecular FormulaC14H14F2N2O
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC NameN-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cc(Oc2cc(F)cc(F)c2)ccn1
InChIInChI=1S/C14H14F2N2O/c1-2-17-9-12-8-13(3-4-18-12)19-14-6-10(15)5-11(16)7-14/h3-8,17H,2,9H2,1H3
InChIKeyRQBXPSPAXYQLFW-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-[[4-(4-bromo-3-methylphenoxy)-2-pyridinyl]methyl]ethanamine
CID 83134272
N-[[4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-2-pyridinyl]methyl]ethanamine
CID 62321397
N-[(4-prop-2-enoxy-2-pyridinyl)methyl]ethanamine
CID 62288081
N-[[4-[2-(2-methoxyethoxy)ethoxy]-2-pyridinyl]methyl]ethanamine
CID 104566339
2-(ethylaminomethyl)-N,N-bis(2-methylpropyl)pyridin-4-amine
CID 62284205
N-[[4-(4-chloro-3-methylphenoxy)-2-pyridinyl]methyl]propan-1-amine
CID 62297574
N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine
CID 62297885
N-[[4-(4-chloro-3-fluorophenoxy)-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 82718553
N-[[2-(3-bromo-5-fluorophenoxy)-4-pyridinyl]methyl]ethanamine
CID 81326230
4-(3-bromo-5-fluorophenoxy)-N-ethylpyridin-2-amine
CID 113368173
N-[[4-[(2-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine
CID 62290868
N-[[4-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]methyl]ethanamine
CID 103180865

Frequently Asked Questions

What is the IUPAC name of N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine (CID 62786202) is N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine is CCNCc1cc(Oc2cc(F)cc(F)c2)ccn1.
What is the InChIKey of N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine?
The InChIKey is RQBXPSPAXYQLFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c1-2-17-9-12-8-13(3-4-18-12)19-14-6-10(15)5-11(16)7-14/h3-8,17H,2,9H2,1H3.
What are the key properties of N-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine?
N-[[4-(3,5-difluorophenoxy)-2-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-[[4-(3,5-difluorophenoxy)-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62786202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).