N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine

C16H19FN2O — CID 61374230

IUPACN-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NC(C)c1cccc(F)c1
InChIInChI=1S/C16H19FN2O/c1-11(2)20-16-15(8-5-9-18-16)19-12(3)13-6-4-7-14(17)10-13/h4-12,19H,1-3H3
InChIKeyGEAGFTZEUVPHDL-UHFFFAOYSA-N
MW274.34 g/mol
LogP4.18
Rot. Bonds5

About N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine

N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine (PubChem CID 61374230) has the molecular formula C16H19FN2O and a molecular weight of 274.34 g/mol. Its IUPAC name is N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound NameN-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
PubChem CID61374230
Molecular FormulaC16H19FN2O
Molecular Weight274.34 g/mol
Exact Mass274.15
IUPAC NameN-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NC(C)c1cccc(F)c1
InChIInChI=1S/C16H19FN2O/c1-11(2)20-16-15(8-5-9-18-16)19-12(3)13-6-4-7-14(17)10-13/h4-12,19H,1-3H3
InChIKeyGEAGFTZEUVPHDL-UHFFFAOYSA-N
XLogP4.18
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,6-difluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61375750
2-chloro-N-[1-(3-fluorophenyl)ethyl]pyridin-3-amine
CID 43690097
N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61374245
N-[(1S)-1-(5-fluoro-3-pyridinyl)ethyl]-2-methoxypyridin-3-amine
CID 99776830
N-[1-(3-fluorophenyl)ethyl]-6-propan-2-yloxypyrimidin-4-amine
CID 66329975
5-chloro-N-[1-(3-fluorophenyl)ethyl]quinolin-8-amine
CID 60928480
2-ethoxy-N-[1-(3-fluorophenyl)ethyl]aniline
CID 43191738
N-[1-(5-methylfuran-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61375389
N-[1-(4-fluoro-3-methoxyphenyl)ethyl]-2-methoxypyridin-3-amine
CID 83075504
N-butan-2-yl-2-propan-2-yloxypyridin-3-amine
CID 61374234
N-[cyclopropyl(phenyl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 63454223
(1R)-1-(3-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 81364970

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine (CID 61374230) is N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine is CC(C)Oc1ncccc1NC(C)c1cccc(F)c1.
What is the InChIKey of N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The InChIKey is GEAGFTZEUVPHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O/c1-11(2)20-16-15(8-5-9-18-16)19-12(3)13-6-4-7-14(17)10-13/h4-12,19H,1-3H3.
What are the key properties of N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine?
N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine has a molecular weight of 274.34 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluorophenyl)ethyl]-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 61374230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).