6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine

C24H23ClFN5O2 — CID 10367334

IUPAC6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine
SMILESFc1ccccc1Nc1c(Cl)cnc2nc(-c3ccc(OCCN4CCOCC4)cc3)[nH]c12
InChIInChI=1S/C24H23ClFN5O2/c25-18-15-27-24-22(21(18)28-20-4-2-1-3-19(20)26)29-23(30-24)16-5-7-17(8-6-16)33-14-11-31-9-12-32-13-10-31/h1-8,15H,9-14H2,(H2,27,28,29,30)
InChIKeyANJGSAUNDPEGJJ-UHFFFAOYSA-N
MW467.93 g/mol
LogP4.87
Rot. Bonds7

About 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine

6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine (PubChem CID 10367334) has the molecular formula C24H23ClFN5O2 and a molecular weight of 467.93 g/mol. Its IUPAC name is 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound Name6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine
PubChem CID10367334
Molecular FormulaC24H23ClFN5O2
Molecular Weight467.93 g/mol
Exact Mass467.15
IUPAC Name6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine
SMILESFc1ccccc1Nc1c(Cl)cnc2nc(-c3ccc(OCCN4CCOCC4)cc3)[nH]c12
InChIInChI=1S/C24H23ClFN5O2/c25-18-15-27-24-22(21(18)28-20-4-2-1-3-19(20)26)29-23(30-24)16-5-7-17(8-6-16)33-14-11-31-9-12-32-13-10-31/h1-8,15H,9-14H2,(H2,27,28,29,30)
InChIKeyANJGSAUNDPEGJJ-UHFFFAOYSA-N
XLogP4.87
TPSA75.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.93
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine?
The IUPAC name of 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine (CID 10367334) is 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine.
What is the SMILES notation for 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine?
The canonical SMILES for 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine is Fc1ccccc1Nc1c(Cl)cnc2nc(-c3ccc(OCCN4CCOCC4)cc3)[nH]c12.
What is the InChIKey of 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine?
The InChIKey is ANJGSAUNDPEGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClFN5O2/c25-18-15-27-24-22(21(18)28-20-4-2-1-3-19(20)26)29-23(30-24)16-5-7-17(8-6-16)33-14-11-31-9-12-32-13-10-31/h1-8,15H,9-14H2,(H2,27,28,29,30).
What are the key properties of 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine?
6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine has a molecular weight of 467.93 g/mol, XLogP of 4.87, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-fluorophenyl)-2-[4-(2-morpholin-4-ylethoxy)phenyl]-1H-imidazo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 10367334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).