2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine

C15H16F2N2 — CID 107503218

IUPAC2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
SMILESCc1cc(C(N)Cc2cccc(F)c2F)cc(C)n1
InChIInChI=1S/C15H16F2N2/c1-9-6-12(7-10(2)19-9)14(18)8-11-4-3-5-13(16)15(11)17/h3-7,14H,8,18H2,1-2H3
InChIKeyNVIJQQURVGOHSY-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.22
Rot. Bonds3

About 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine

2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine (PubChem CID 107503218) has the molecular formula C15H16F2N2 and a molecular weight of 262.30 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
PubChem CID107503218
Molecular FormulaC15H16F2N2
Molecular Weight262.30 g/mol
Exact Mass262.13
IUPAC Name2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
SMILESCc1cc(C(N)Cc2cccc(F)c2F)cc(C)n1
InChIInChI=1S/C15H16F2N2/c1-9-6-12(7-10(2)19-9)14(18)8-11-4-3-5-13(16)15(11)17/h3-7,14H,8,18H2,1-2H3
InChIKeyNVIJQQURVGOHSY-UHFFFAOYSA-N
XLogP3.22
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanol
CID 107502950
2-(2,3-difluorophenyl)-1-(3,4-difluorophenyl)ethanamine
CID 55095679
1-(4-chloro-3-fluorophenyl)-2-(2,3-difluorophenyl)ethanamine
CID 107988898
2-(2,3-difluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanamine
CID 81279328
2-(2,3-difluorophenyl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 113329452
2-(2,3-difluorophenyl)-1-(2-ethyl-5-methylpyrazol-3-yl)ethanamine
CID 105137759
1-(5-bromothiophen-3-yl)-2-(2,3-difluorophenyl)ethanamine
CID 105137743
2-(2-chloro-5-fluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
CID 107503345
2-(2,3-difluorophenyl)-1-(3-ethoxyphenyl)ethanamine
CID 62606426
2-(2,3-difluorophenyl)-1-naphthalen-1-ylethanamine
CID 62715879
2-(2,3-difluorophenyl)-1-(2-methyl-1,3-thiazol-5-yl)ethanamine
CID 114031185
2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
CID 107503055

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine?
The IUPAC name of 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine (CID 107503218) is 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine.
What is the SMILES notation for 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine?
The canonical SMILES for 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine is Cc1cc(C(N)Cc2cccc(F)c2F)cc(C)n1.
What is the InChIKey of 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine?
The InChIKey is NVIJQQURVGOHSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2/c1-9-6-12(7-10(2)19-9)14(18)8-11-4-3-5-13(16)15(11)17/h3-7,14H,8,18H2,1-2H3.
What are the key properties of 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine?
2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine has a molecular weight of 262.30 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine is sourced from PubChem (CID 107503218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).