2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine

C14H11Cl2F3N2 — CID 107312168

IUPAC2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
SMILESNC(Cc1cccc(Cl)c1Cl)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H11Cl2F3N2/c15-10-3-1-2-8(13(10)16)6-11(20)12-5-4-9(7-21-12)14(17,18)19/h1-5,7,11H,6,20H2
InChIKeyJZPQQMAARIZLMO-UHFFFAOYSA-N
MW335.16 g/mol
LogP4.65
Rot. Bonds3

About 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine

2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine (PubChem CID 107312168) has the molecular formula C14H11Cl2F3N2 and a molecular weight of 335.16 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
PubChem CID107312168
Molecular FormulaC14H11Cl2F3N2
Molecular Weight335.16 g/mol
Exact Mass334.03
IUPAC Name2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
SMILESNC(Cc1cccc(Cl)c1Cl)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H11Cl2F3N2/c15-10-3-1-2-8(13(10)16)6-11(20)12-5-4-9(7-21-12)14(17,18)19/h1-5,7,11H,6,20H2
InChIKeyJZPQQMAARIZLMO-UHFFFAOYSA-N
XLogP4.65
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.16
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-dimethylphenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 105174687
2-(2,3-dichlorophenyl)-1-(2H-triazol-4-yl)ethanamine
CID 107308912
4,4,4-trifluoro-1-[5-(trifluoromethyl)-2-pyridinyl]butan-1-amine
CID 105156496
2-(1,3-thiazol-2-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 105169295
3-ethyl-1-[5-(trifluoromethyl)-2-pyridinyl]pentan-1-amine
CID 105176912
2-cyclopropyl-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 112693374
(3,4-dichlorophenyl)-[5-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105077091
2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine
CID 21148415
2-(2,3-dichlorophenyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 107311807
2-(1-ethylpyrazol-4-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 105115043
1-[5-(trifluoromethyl)-2-pyridinyl]decan-1-amine
CID 105124478
1-[5-(trifluoromethyl)-2-pyridinyl]octan-1-amine
CID 105125097

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine?
The IUPAC name of 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine (CID 107312168) is 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine?
The canonical SMILES for 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine is NC(Cc1cccc(Cl)c1Cl)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine?
The InChIKey is JZPQQMAARIZLMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2F3N2/c15-10-3-1-2-8(13(10)16)6-11(20)12-5-4-9(7-21-12)14(17,18)19/h1-5,7,11H,6,20H2.
What are the key properties of 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine?
2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine has a molecular weight of 335.16 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine is sourced from PubChem (CID 107312168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).