3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine

C16H20FN3 — CID 107111565

IUPAC3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine
SMILESCCNC(Cc1cccnc1N)c1cccc(C)c1F
InChIInChI=1S/C16H20FN3/c1-3-19-14(10-12-7-5-9-20-16(12)18)13-8-4-6-11(2)15(13)17/h4-9,14,19H,3,10H2,1-2H3,(H2,18,20)
InChIKeyALXQKHVLONHSIJ-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.00
Rot. Bonds5

About 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine

3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine (PubChem CID 107111565) has the molecular formula C16H20FN3 and a molecular weight of 273.35 g/mol. Its IUPAC name is 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine
PubChem CID107111565
Molecular FormulaC16H20FN3
Molecular Weight273.35 g/mol
Exact Mass273.16
IUPAC Name3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine
SMILESCCNC(Cc1cccnc1N)c1cccc(C)c1F
InChIInChI=1S/C16H20FN3/c1-3-19-14(10-12-7-5-9-20-16(12)18)13-8-4-6-11(2)15(13)17/h4-9,14,19H,3,10H2,1-2H3,(H2,18,20)
InChIKeyALXQKHVLONHSIJ-UHFFFAOYSA-N
XLogP3.00
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(2,6-difluorophenyl)-2-(ethylamino)ethyl]pyridin-2-amine
CID 79522491
3-[2-(5-bromo-2-fluorophenyl)-2-(ethylamino)ethyl]pyridin-2-amine
CID 114894906
N-ethyl-1-(2-fluoro-3-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105377456
N-ethyl-1-(2-fluoro-3-methylphenyl)-2-(1,3-thiazol-2-yl)ethanamine
CID 105015235
3-[2-(4-fluoro-2-methylphenyl)-2-(propylamino)ethyl]pyridin-2-amine
CID 81269673
2-(2,6-dimethylphenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105174636
N-ethyl-1-(2-fluoro-3-methylphenyl)-2-(4-methylphenyl)ethanamine
CID 81477799
3-[2-(2,6-difluorophenyl)-2-(propylamino)ethyl]pyridin-2-amine
CID 79517746
1-(2-chloro-3-fluorophenyl)-N-ethyl-2-(3-methyl-2-pyridinyl)ethanamine
CID 81454498
1-(2,3-difluorophenyl)-N-ethyl-2-pyridin-2-ylethanamine
CID 63988196
2-(5-bromo-2-fluorophenyl)-N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105132112
2-(3-chloro-2-fluorophenyl)-N-ethyl-1-(4-methyl-3-pyridinyl)ethanamine
CID 82806395

Frequently Asked Questions

What is the IUPAC name of 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine?
The IUPAC name of 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine (CID 107111565) is 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine.
What is the SMILES notation for 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine?
The canonical SMILES for 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine is CCNC(Cc1cccnc1N)c1cccc(C)c1F.
What is the InChIKey of 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine?
The InChIKey is ALXQKHVLONHSIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c1-3-19-14(10-12-7-5-9-20-16(12)18)13-8-4-6-11(2)15(13)17/h4-9,14,19H,3,10H2,1-2H3,(H2,18,20).
What are the key properties of 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine?
3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine has a molecular weight of 273.35 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(ethylamino)-2-(2-fluoro-3-methylphenyl)ethyl]pyridin-2-amine is sourced from PubChem (CID 107111565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).