2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine

C13H12Cl2N2 — CID 65321274

IUPAC2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine
SMILESNC(Cc1cc(Cl)ccc1Cl)c1cccnc1
InChIInChI=1S/C13H12Cl2N2/c14-11-3-4-12(15)10(6-11)7-13(16)9-2-1-5-17-8-9/h1-6,8,13H,7,16H2
InChIKeyTYVYXOQGJFYGTR-UHFFFAOYSA-N
MW267.16 g/mol
LogP3.63
Rot. Bonds3

About 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine

2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine (PubChem CID 65321274) has the molecular formula C13H12Cl2N2 and a molecular weight of 267.16 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine
PubChem CID65321274
Molecular FormulaC13H12Cl2N2
Molecular Weight267.16 g/mol
Exact Mass266.04
IUPAC Name2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine
SMILESNC(Cc1cc(Cl)ccc1Cl)c1cccnc1
InChIInChI=1S/C13H12Cl2N2/c14-11-3-4-12(15)10(6-11)7-13(16)9-2-1-5-17-8-9/h1-6,8,13H,7,16H2
InChIKeyTYVYXOQGJFYGTR-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

2-(2,3-dichlorophenyl)-1-pyridin-3-ylethanamine
CID 21148415
2-(2,5-dichlorophenyl)-1-pyrazin-2-ylethanamine
CID 65321517
2-(2,5-dichlorophenyl)-1-(3-methoxyphenyl)ethanamine
CID 65321564
2-(2,5-dichlorophenyl)-1-(4-propan-2-ylphenyl)ethanamine
CID 65321175
3-[(2,5-dichlorophenyl)methyl]pyridine
CID 102311529
2-(2,5-dichlorophenyl)-1-(3-methoxy-4-pyridinyl)ethanamine
CID 105065635
1-pyridin-3-ylpropane-1,3-diamine
CID 116932848
[1-(2,5-dichlorophenyl)-4-pyridin-3-ylbutan-2-yl]hydrazine
CID 105309892
2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine
CID 105151425
2-phenyl-1-pyridin-3-ylethanamine
CID 10352711
(1S)-2-phenyl-1-pyridin-3-ylethanamine
CID 93312491
[2-(2-chloro-5-fluorophenyl)-1-pyridin-3-ylethyl]hydrazine
CID 102623237

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine?
The IUPAC name of 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine (CID 65321274) is 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine?
The canonical SMILES for 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine is NC(Cc1cc(Cl)ccc1Cl)c1cccnc1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine?
The InChIKey is TYVYXOQGJFYGTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2N2/c14-11-3-4-12(15)10(6-11)7-13(16)9-2-1-5-17-8-9/h1-6,8,13H,7,16H2.
What are the key properties of 2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine?
2-(2,5-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-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine is sourced from PubChem (CID 65321274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).