2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine

C14H11Cl2N3O — CID 79816142

IUPAC2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine
SMILESCCOc1ccc2[nH]c(-c3cc(Cl)ccc3Cl)nc2n1
InChIInChI=1S/C14H11Cl2N3O/c1-2-20-12-6-5-11-14(18-12)19-13(17-11)9-7-8(15)3-4-10(9)16/h3-7H,2H2,1H3,(H,17,18,19)
InChIKeyBDTWSEBJIPMCFT-UHFFFAOYSA-N
MW308.17 g/mol
LogP4.33
Rot. Bonds3

About 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine

2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine (PubChem CID 79816142) has the molecular formula C14H11Cl2N3O and a molecular weight of 308.17 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine
PubChem CID79816142
Molecular FormulaC14H11Cl2N3O
Molecular Weight308.17 g/mol
Exact Mass307.03
IUPAC Name2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine
SMILESCCOc1ccc2[nH]c(-c3cc(Cl)ccc3Cl)nc2n1
InChIInChI=1S/C14H11Cl2N3O/c1-2-20-12-6-5-11-14(18-12)19-13(17-11)9-7-8(15)3-4-10(9)16/h3-7H,2H2,1H3,(H,17,18,19)
InChIKeyBDTWSEBJIPMCFT-UHFFFAOYSA-N
XLogP4.33
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.17
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine (CID 79816142) is 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine is CCOc1ccc2[nH]c(-c3cc(Cl)ccc3Cl)nc2n1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine?
The InChIKey is BDTWSEBJIPMCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3O/c1-2-20-12-6-5-11-14(18-12)19-13(17-11)9-7-8(15)3-4-10(9)16/h3-7H,2H2,1H3,(H,17,18,19).
What are the key properties of 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine?
2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine has a molecular weight of 308.17 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 79816142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).