4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine

C25H25ClN4O2 — CID 141085119

IUPAC4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine
SMILESClc1cnc2nc(-c3ccc(OCCN4CCOCC4)cc3)n(Cc3ccccc3)c2c1
InChIInChI=1S/C25H25ClN4O2/c26-21-16-23-24(27-17-21)28-25(30(23)18-19-4-2-1-3-5-19)20-6-8-22(9-7-20)32-15-12-29-10-13-31-14-11-29/h1-9,16-17H,10-15,18H2
InChIKeyHMWSCTOXGTVPER-UHFFFAOYSA-N
MW448.95 g/mol
LogP4.51
Rot. Bonds7

About 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine

4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine (PubChem CID 141085119) has the molecular formula C25H25ClN4O2 and a molecular weight of 448.95 g/mol. Its IUPAC name is 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine
PubChem CID141085119
Molecular FormulaC25H25ClN4O2
Molecular Weight448.95 g/mol
Exact Mass448.17
IUPAC Name4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine
SMILESClc1cnc2nc(-c3ccc(OCCN4CCOCC4)cc3)n(Cc3ccccc3)c2c1
InChIInChI=1S/C25H25ClN4O2/c26-21-16-23-24(27-17-21)28-25(30(23)18-19-4-2-1-3-5-19)20-6-8-22(9-7-20)32-15-12-29-10-13-31-14-11-29/h1-9,16-17H,10-15,18H2
InChIKeyHMWSCTOXGTVPER-UHFFFAOYSA-N
XLogP4.51
TPSA52.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.95
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine with MolForge

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Related Compounds

N-benzyl-5-[4-(2-morpholin-4-ylethoxy)phenyl]pyridine-2-carboxamide
CID 98007458
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342
4-[2-[4-(2-chloropyrimidin-4-yl)phenoxy]ethyl]morpholine
CID 58930607
2-[benzyl-[6-chloro-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-yl]amino]ethanol
CID 10413918
N-benzyl-5-[4-(2-morpholin-4-ylethoxy)phenyl]pyridine-2-carboxamide;dihydrochloride
CID 163320860
4-[2-[4-[4-(2-fluoro-4-phenylbut-2-enyl)phenyl]phenoxy]ethyl]morpholine
CID 91083493
6-chloro-2-[4-(2-morpholin-4-ylethoxy)phenyl]-N-(1-phenylethyl)-1H-imidazo[4,5-b]pyridin-7-amine
CID 69209627
4-[2-[2-[3-[(5-chlorobenzotriazol-1-yl)methyl]phenyl]pyrimidin-5-yl]oxyethyl]morpholine
CID 58289756
1-benzyl-6-(2-pyrrolidin-1-ylethoxy)-2-(3,4,5-trimethoxyphenyl)benzimidazole
CID 19353930
4-[2-(4-methylphenoxy)ethyl]morpholine;oxalic acid
CID 44827969
4-[2-[4-(3-fluoro-4-methylphenyl)phenoxy]ethyl]morpholine
CID 123641546
4-[2-[2-[3-(chloromethyl)phenyl]pyrimidin-5-yl]oxyethyl]morpholine;hydrochloride
CID 66985501

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine?
The IUPAC name of 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine (CID 141085119) is 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine is Clc1cnc2nc(-c3ccc(OCCN4CCOCC4)cc3)n(Cc3ccccc3)c2c1.
What is the InChIKey of 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine?
The InChIKey is HMWSCTOXGTVPER-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25ClN4O2/c26-21-16-23-24(27-17-21)28-25(30(23)18-19-4-2-1-3-5-19)20-6-8-22(9-7-20)32-15-12-29-10-13-31-14-11-29/h1-9,16-17H,10-15,18H2.
What are the key properties of 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine?
4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine has a molecular weight of 448.95 g/mol, XLogP of 4.51, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(1-benzyl-6-chloroimidazo[4,5-b]pyridin-2-yl)phenoxy]ethyl]morpholine is sourced from PubChem (CID 141085119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).