2,5-bis(2,3,5-trichlorophenyl)pyridine

C17H7Cl6N — CID 134637222

IUPAC2,5-bis(2,3,5-trichlorophenyl)pyridine
SMILESClc1cc(Cl)c(Cl)c(-c2ccc(-c3cc(Cl)cc(Cl)c3Cl)nc2)c1
InChIInChI=1S/C17H7Cl6N/c18-9-3-11(16(22)13(20)5-9)8-1-2-15(24-7-8)12-4-10(19)6-14(21)17(12)23/h1-7H
InChIKeyKGICSMPXOFBIED-UHFFFAOYSA-N
MW437.97 g/mol
LogP8.34
Rot. Bonds2

About 2,5-bis(2,3,5-trichlorophenyl)pyridine

2,5-bis(2,3,5-trichlorophenyl)pyridine (PubChem CID 134637222) has the molecular formula C17H7Cl6N and a molecular weight of 437.97 g/mol. Its IUPAC name is 2,5-bis(2,3,5-trichlorophenyl)pyridine.

Molecular Properties

Compound Name2,5-bis(2,3,5-trichlorophenyl)pyridine
PubChem CID134637222
Molecular FormulaC17H7Cl6N
Molecular Weight437.97 g/mol
Exact Mass434.87
IUPAC Name2,5-bis(2,3,5-trichlorophenyl)pyridine
SMILESClc1cc(Cl)c(Cl)c(-c2ccc(-c3cc(Cl)cc(Cl)c3Cl)nc2)c1
InChIInChI=1S/C17H7Cl6N/c18-9-3-11(16(22)13(20)5-9)8-1-2-15(24-7-8)12-4-10(19)6-14(21)17(12)23/h1-7H
InChIKeyKGICSMPXOFBIED-UHFFFAOYSA-N
XLogP8.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.97
LogP ≤ 58.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 2,5-bis(2,3,5-trichlorophenyl)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-5-(2,3,5-trichlorophenyl)pyridin-3-amine
CID 134636944
4-iodo-2,5-bis(2,3,5-trichlorophenyl)pyridine
CID 134637060
3-chloro-5-(2,3,5-trichlorophenyl)pyridine-2-carbaldehyde
CID 134637334
2-[5-fluoro-2-(2,3,5-trichlorophenyl)-4-pyridinyl]acetic acid
CID 134637610
[3,6-bis(2,3,5-trichlorophenyl)-2-pyridinyl]methanol
CID 134637996
4-chloro-6-(2,3,5-trichlorophenyl)pyrimidine
CID 24902237
1-(4-bromo-3-chlorophenyl)-2,3,5-trichlorobenzene
CID 101423965
4-(2,3,5-trichlorophenyl)pyridin-2-amine
CID 119008839
2-chloro-3-nitro-5-(2,3,5-trichlorophenyl)pyridine
CID 119024598
3-amino-6-(2,3,5-trichlorophenyl)pyridine-2-carboxylic acid
CID 134636979
methyl 5-amino-2-(2,3,5-trichlorophenyl)pyridine-4-carboxylate
CID 133087054
1,2,5-trichloro-3-(4-chloro-3-methoxyphenyl)benzene
CID 134627061

Frequently Asked Questions

What is the IUPAC name of 2,5-bis(2,3,5-trichlorophenyl)pyridine?
The IUPAC name of 2,5-bis(2,3,5-trichlorophenyl)pyridine (CID 134637222) is 2,5-bis(2,3,5-trichlorophenyl)pyridine.
What is the SMILES notation for 2,5-bis(2,3,5-trichlorophenyl)pyridine?
The canonical SMILES for 2,5-bis(2,3,5-trichlorophenyl)pyridine is Clc1cc(Cl)c(Cl)c(-c2ccc(-c3cc(Cl)cc(Cl)c3Cl)nc2)c1.
What is the InChIKey of 2,5-bis(2,3,5-trichlorophenyl)pyridine?
The InChIKey is KGICSMPXOFBIED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H7Cl6N/c18-9-3-11(16(22)13(20)5-9)8-1-2-15(24-7-8)12-4-10(19)6-14(21)17(12)23/h1-7H.
What are the key properties of 2,5-bis(2,3,5-trichlorophenyl)pyridine?
2,5-bis(2,3,5-trichlorophenyl)pyridine has a molecular weight of 437.97 g/mol, XLogP of 8.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(2,3,5-trichlorophenyl)pyridine is sourced from PubChem (CID 134637222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).