N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine

C15H17FN2O2 — CID 83075504

IUPACN-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine
SMILESCOc1cc(C(C)Nc2cccnc2OC)ccc1F
InChIInChI=1S/C15H17FN2O2/c1-10(11-6-7-12(16)14(9-11)19-2)18-13-5-4-8-17-15(13)20-3/h4-10,18H,1-3H3
InChIKeyMPORFYDVIVOSMI-UHFFFAOYSA-N
MW276.31 g/mol
LogP3.41
Rot. Bonds5

About N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine

N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine (PubChem CID 83075504) has the molecular formula C15H17FN2O2 and a molecular weight of 276.31 g/mol. Its IUPAC name is N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine.

Molecular Properties

Compound NameN-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine
PubChem CID83075504
Molecular FormulaC15H17FN2O2
Molecular Weight276.31 g/mol
Exact Mass276.13
IUPAC NameN-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine
SMILESCOc1cc(C(C)Nc2cccnc2OC)ccc1F
InChIInChI=1S/C15H17FN2O2/c1-10(11-6-7-12(16)14(9-11)19-2)18-13-5-4-8-17-15(13)20-3/h4-10,18H,1-3H3
InChIKeyMPORFYDVIVOSMI-UHFFFAOYSA-N
XLogP3.41
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-fluoro-3-methoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 82991384
2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine
CID 43721905
N-[(1S)-1-(5-fluoro-3-pyridinyl)ethyl]-2-methoxypyridin-3-amine
CID 99776830
N-[1-(2-fluorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721902
N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-4-methylpyridin-3-amine
CID 83075673
3,4,5-trifluoro-N-[1-(4-fluoro-3-methoxyphenyl)ethyl]aniline
CID 83058996
N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxy-4-methylaniline
CID 83058583
N-[1-(2,5-dichlorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721804
N-[1-(4-chloro-3-fluorophenyl)ethyl]-2-ethoxypyridin-3-amine
CID 83069768
2-bromo-4-chloro-N-[1-(4-fluoro-3-methoxyphenyl)ethyl]aniline
CID 83075597
4-chloro-N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-iodoaniline
CID 107632142
N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61374230

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine?
The IUPAC name of N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine (CID 83075504) is N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine.
What is the SMILES notation for N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine?
The canonical SMILES for N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine is COc1cc(C(C)Nc2cccnc2OC)ccc1F.
What is the InChIKey of N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine?
The InChIKey is MPORFYDVIVOSMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O2/c1-10(11-6-7-12(16)14(9-11)19-2)18-13-5-4-8-17-15(13)20-3/h4-10,18H,1-3H3.
What are the key properties of N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine?
N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine has a molecular weight of 276.31 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine is sourced from PubChem (CID 83075504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).