1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine

C14H14F2N2O — CID 103395231

IUPAC1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine
SMILESCOc1ccc(C(C)(N)c2ccc(F)cn2)c(F)c1
InChIInChI=1S/C14H14F2N2O/c1-14(17,13-6-3-9(15)8-18-13)11-5-4-10(19-2)7-12(11)16/h3-8H,17H2,1-2H3
InChIKeyDVUJSXRUFWBYOP-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.59
Rot. Bonds3

About 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine

1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine (PubChem CID 103395231) has the molecular formula C14H14F2N2O and a molecular weight of 264.28 g/mol. Its IUPAC name is 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine
PubChem CID103395231
Molecular FormulaC14H14F2N2O
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine
SMILESCOc1ccc(C(C)(N)c2ccc(F)cn2)c(F)c1
InChIInChI=1S/C14H14F2N2O/c1-14(17,13-6-3-9(15)8-18-13)11-5-4-10(19-2)7-12(11)16/h3-8H,17H2,1-2H3
InChIKeyDVUJSXRUFWBYOP-UHFFFAOYSA-N
XLogP2.59
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-difluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanamine
CID 83124942
1-(5-fluoro-2-pyridinyl)-1-(4-methoxyphenyl)ethanamine
CID 83124560
1-(5-fluoro-2-pyridinyl)-1-(2,4,5-trimethylphenyl)ethanamine
CID 83125097
1-(3,4-dimethylphenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine
CID 103395200
1-(4-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanamine
CID 83124710
1-(5-fluoro-2-pyridinyl)-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 115940675
5-fluoro-2-(2-fluoro-4-methoxyphenyl)pyridine
CID 70819002
2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine
CID 69346788
2-fluoro-4-methoxy-1-(2-methylbutan-2-yl)benzene
CID 134360467
1-[dichloro-(4-fluorophenyl)methyl]-2-fluoro-4-methoxybenzene
CID 69055296
1-(4-chloro-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 83124846
1-(5-fluoro-2-pyridinyl)-1-(5-methylthiophen-2-yl)ethanamine
CID 83126596

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine?
The IUPAC name of 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine (CID 103395231) is 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine.
What is the SMILES notation for 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine?
The canonical SMILES for 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine is COc1ccc(C(C)(N)c2ccc(F)cn2)c(F)c1.
What is the InChIKey of 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine?
The InChIKey is DVUJSXRUFWBYOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c1-14(17,13-6-3-9(15)8-18-13)11-5-4-10(19-2)7-12(11)16/h3-8H,17H2,1-2H3.
What are the key properties of 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine?
1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine has a molecular weight of 264.28 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine is sourced from PubChem (CID 103395231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).