1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine

C15H17FN2O — CID 82808005

IUPAC1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine
SMILESCNC(Cc1ccccn1)c1cccc(OC)c1F
InChIInChI=1S/C15H17FN2O/c1-17-13(10-11-6-3-4-9-18-11)12-7-5-8-14(19-2)15(12)16/h3-9,13,17H,10H2,1-2H3
InChIKeyWWOOPQPBUGCYPM-UHFFFAOYSA-N
MW260.31 g/mol
LogP2.73
Rot. Bonds5

About 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine

1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine (PubChem CID 82808005) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine.

Molecular Properties

Compound Name1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine
PubChem CID82808005
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine
SMILESCNC(Cc1ccccn1)c1cccc(OC)c1F
InChIInChI=1S/C15H17FN2O/c1-17-13(10-11-6-3-4-9-18-11)12-7-5-8-14(19-2)15(12)16/h3-9,13,17H,10H2,1-2H3
InChIKeyWWOOPQPBUGCYPM-UHFFFAOYSA-N
XLogP2.73
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-difluoro-4-methylphenyl)-N-methyl-2-pyridin-2-ylethanamine
CID 107513169
1-(5-fluoro-2-methoxyphenyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 105176576
N-methyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine
CID 60818162
N-methyl-2-pyridin-2-yl-1-quinoxalin-5-ylethanamine
CID 105158086
[1-(2-fluoro-3-methylphenyl)-2-pyridin-2-ylethyl]hydrazine
CID 105315397
1-(2-methoxyphenyl)-2-pyridin-2-ylethanamine
CID 43118872
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-2-pyridin-2-ylethanamine
CID 106680429
1-(3-bromo-2-fluorophenyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 106647594
1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-propan-2-yloxyethanamine
CID 105174719
1-(2,3-difluorophenyl)-N-ethyl-2-pyridin-2-ylethanamine
CID 63988196
1-(2-fluoro-3-methoxyphenyl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 82808523
1-(2-fluoro-3-methoxyphenyl)-1-(2-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105174824

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine?
The IUPAC name of 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine (CID 82808005) is 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine.
What is the SMILES notation for 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine?
The canonical SMILES for 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine is CNC(Cc1ccccn1)c1cccc(OC)c1F.
What is the InChIKey of 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine?
The InChIKey is WWOOPQPBUGCYPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-17-13(10-11-6-3-4-9-18-11)12-7-5-8-14(19-2)15(12)16/h3-9,13,17H,10H2,1-2H3.
What are the key properties of 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine?
1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine has a molecular weight of 260.31 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-3-methoxyphenyl)-N-methyl-2-pyridin-2-ylethanamine is sourced from PubChem (CID 82808005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).