2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine

C13H12Cl2N2 — CID 21148415

IUPAC2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine
SMILESNC(Cc1cccc(Cl)c1Cl)c1cccnc1
InChIInChI=1S/C13H12Cl2N2/c14-11-5-1-3-9(13(11)15)7-12(16)10-4-2-6-17-8-10/h1-6,8,12H,7,16H2
InChIKeyVVONJZKAWVSXQA-UHFFFAOYSA-N
MW267.16 g/mol
LogP3.63
Rot. Bonds3

About 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine

2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine (PubChem CID 21148415) has the molecular formula C13H12Cl2N2 and a molecular weight of 267.16 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine
PubChem CID21148415
Molecular FormulaC13H12Cl2N2
Molecular Weight267.16 g/mol
Exact Mass266.04
IUPAC Name2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine
SMILESNC(Cc1cccc(Cl)c1Cl)c1cccnc1
InChIInChI=1S/C13H12Cl2N2/c14-11-5-1-3-9(13(11)15)7-12(16)10-4-2-6-17-8-10/h1-6,8,12H,7,16H2
InChIKeyVVONJZKAWVSXQA-UHFFFAOYSA-N
XLogP3.63
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.16
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dichlorophenyl)-3-pyridin-3-ylpropan-2-amine
CID 107308540
2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine
CID 65321274
(1S)-N-[(2,3-dichlorophenyl)methyl]-1-pyridin-3-ylethanamine
CID 28655829
1-(3-bromophenyl)-2-(2,3-dichlorophenyl)ethanamine
CID 107308364
2-(2,3-dichlorophenyl)-1-quinoxalin-6-ylethanamine
CID 107308633
2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine
CID 22299211
(1S)-2-phenyl-1-pyridin-3-ylethanamine
CID 93312491
2-phenyl-1-pyridin-3-ylethanamine
CID 10352711
(2,6-dichlorophenyl)-pyridin-3-ylmethanamine
CID 115799088
[2-(2,6-dichlorophenyl)-1-pyridin-3-ylethyl]hydrazine
CID 105196072
2-(2,3-dichlorophenyl)-1-(2H-triazol-4-yl)ethanamine
CID 107308912
1-(4-chloro-3-fluorophenyl)-2-(2,3-dichlorophenyl)ethanamine
CID 107996136

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine?
The IUPAC name of 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine (CID 21148415) is 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine?
The canonical SMILES for 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine is NC(Cc1cccc(Cl)c1Cl)c1cccnc1.
What is the InChIKey of 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine?
The InChIKey is VVONJZKAWVSXQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2N2/c14-11-5-1-3-9(13(11)15)7-12(16)10-4-2-6-17-8-10/h1-6,8,12H,7,16H2.
What are the key properties of 2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine?
2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine has a molecular weight of 267.16 g/mol, XLogP of 3.63, 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-pyridin-3-ylethanamine is sourced from PubChem (CID 21148415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).