6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine

C19H20BrClN4O — CID 70685227

IUPAC6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
SMILESClc1c(Br)cnc2nc(-c3ccc(OCCN4CCCCC4)cc3)[nH]c12
InChIInChI=1S/C19H20BrClN4O/c20-15-12-22-19-17(16(15)21)23-18(24-19)13-4-6-14(7-5-13)26-11-10-25-8-2-1-3-9-25/h4-7,12H,1-3,8-11H2,(H,22,23,24)
InChIKeyAITCLJHEQHOUPD-UHFFFAOYSA-N
MW435.75 g/mol
LogP4.91
Rot. Bonds5

About 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine

6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine (PubChem CID 70685227) has the molecular formula C19H20BrClN4O and a molecular weight of 435.75 g/mol. Its IUPAC name is 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
PubChem CID70685227
Molecular FormulaC19H20BrClN4O
Molecular Weight435.75 g/mol
Exact Mass434.05
IUPAC Name6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
SMILESClc1c(Br)cnc2nc(-c3ccc(OCCN4CCCCC4)cc3)[nH]c12
InChIInChI=1S/C19H20BrClN4O/c20-15-12-22-19-17(16(15)21)23-18(24-19)13-4-6-14(7-5-13)26-11-10-25-8-2-1-3-9-25/h4-7,12H,1-3,8-11H2,(H,22,23,24)
InChIKeyAITCLJHEQHOUPD-UHFFFAOYSA-N
XLogP4.91
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.75
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine with MolForge

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Related Compounds

6-chloro-2-[4-(2-morpholin-4-ylethoxy)phenyl]-N-(1-phenylethyl)-1H-imidazo[4,5-b]pyridin-7-amine
CID 69209627
1-[2-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]piperidin-3-ol
CID 69215022
4-[2-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-2-nitrophenoxy]ethyl]morpholine;6-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
CID 158925150
2-[benzyl-[6-chloro-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-yl]amino]ethanol
CID 10413918
1-[2-(4-phenylphenoxy)ethyl]piperidine
CID 58483683
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
2-[4-[6-chloro-7-[[1-(2-phenoxyethyl)piperidin-4-yl]amino]-1H-imidazo[4,5-b]pyridin-2-yl]phenoxy]-N-methylacetamide
CID 122446497
2-[2-[5-(4-chlorophenyl)-2-pyridinyl]ethynyl]-5-(2-pyrrolidin-1-ylethoxy)pyridine
CID 59835871
6-bromo-2-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-1H-imidazo[4,5-b]pyridine;bis(2,2,2-trifluoroacetic acid)
CID 87736156
lithium 1-[2-(phenoxy)ethyl]piperidine
CID 57351466
2-[4-[6-bromo-7-[4-[[6-(trifluoromethyl)-3-pyridinyl]methyl]piperazin-1-yl]-1H-imidazo[4,5-b]pyridin-2-yl]phenoxy]ethanol
CID 25151591
6-bromo-2-[4-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethoxy]phenyl]-1H-imidazo[4,5-b]pyridine;bis(2,2,2-trifluoroacetic acid)
CID 87735688

Frequently Asked Questions

What is the IUPAC name of 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine (CID 70685227) is 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine is Clc1c(Br)cnc2nc(-c3ccc(OCCN4CCCCC4)cc3)[nH]c12.
What is the InChIKey of 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is AITCLJHEQHOUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20BrClN4O/c20-15-12-22-19-17(16(15)21)23-18(24-19)13-4-6-14(7-5-13)26-11-10-25-8-2-1-3-9-25/h4-7,12H,1-3,8-11H2,(H,22,23,24).
What are the key properties of 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine?
6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 435.75 g/mol, XLogP of 4.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-7-chloro-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 70685227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).