N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine

C17H19FN2 — CID 83117763

IUPACN-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine
SMILESCC(NC(c1ccccc1)C1CC1)c1ccc(F)cn1
InChIInChI=1S/C17H19FN2/c1-12(16-10-9-15(18)11-19-16)20-17(14-7-8-14)13-5-3-2-4-6-13/h2-6,9-12,14,17,20H,7-8H2,1H3
InChIKeyFOSFYIMGFDIYQM-UHFFFAOYSA-N
MW270.35 g/mol
LogP4.02
Rot. Bonds5

About N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine

N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine (PubChem CID 83117763) has the molecular formula C17H19FN2 and a molecular weight of 270.35 g/mol. Its IUPAC name is N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine.

Molecular Properties

Compound NameN-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine
PubChem CID83117763
Molecular FormulaC17H19FN2
Molecular Weight270.35 g/mol
Exact Mass270.15
IUPAC NameN-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine
SMILESCC(NC(c1ccccc1)C1CC1)c1ccc(F)cn1
InChIInChI=1S/C17H19FN2/c1-12(16-10-9-15(18)11-19-16)20-17(14-7-8-14)13-5-3-2-4-6-13/h2-6,9-12,14,17,20H,7-8H2,1H3
InChIKeyFOSFYIMGFDIYQM-UHFFFAOYSA-N
XLogP4.02
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-N-[1-(5-fluoro-2-pyridinyl)ethyl]ethanamine
CID 83117431
(2S)-2-[1-(5-fluoro-2-pyridinyl)ethylamino]-2-phenylethanol
CID 103894880
1-cyclopropyl-N-[1-(5-fluoro-2-pyridinyl)ethyl]propan-2-amine
CID 83119407
(1S)-1-cycloheptyl-N-[1-(5-fluoro-2-pyridinyl)ethyl]ethanamine
CID 83120103
N-[1-(5-fluoro-2-pyridinyl)ethyl]aniline
CID 83117498
methyl 2-[1-(5-fluoro-2-pyridinyl)ethylamino]-2-phenylacetate
CID 83119608
(1R)-N-[cyclopropyl(phenyl)methyl]-1-pyridin-4-ylethanamine
CID 81406216
N-[cyclopropyl(phenyl)methyl]-1-(3,4-difluorophenyl)ethanamine
CID 43724263
1-cyclopropyl-N-[cyclopropyl(phenyl)methyl]-1-phenylmethanamine
CID 61312190
N-[1-(5-fluoro-2-pyridinyl)ethyl]-3-phenylbutan-1-amine
CID 83119801
N-[cyclopropyl(phenyl)methyl]-1-imidazo[2,1-b][1,3]thiazol-5-ylethanamine
CID 138048413
(1R)-N-[cyclopropyl-(4-fluorophenyl)methyl]-1-(3-methylphenyl)ethanamine
CID 81369428

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine?
The IUPAC name of N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine (CID 83117763) is N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine.
What is the SMILES notation for N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine?
The canonical SMILES for N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine is CC(NC(c1ccccc1)C1CC1)c1ccc(F)cn1.
What is the InChIKey of N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine?
The InChIKey is FOSFYIMGFDIYQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2/c1-12(16-10-9-15(18)11-19-16)20-17(14-7-8-14)13-5-3-2-4-6-13/h2-6,9-12,14,17,20H,7-8H2,1H3.
What are the key properties of N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine?
N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine has a molecular weight of 270.35 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl(phenyl)methyl]-1-(5-fluoro-2-pyridinyl)ethanamine is sourced from PubChem (CID 83117763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).