4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine

C23H20ClFN4O — CID 121309794

IUPAC4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
SMILESFc1cccnc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1
InChIInChI=1S/C23H20ClFN4O/c24-18-6-3-16(4-7-18)23-20(15-28-10-12-30-13-11-28)29-14-17(5-8-21(29)27-23)22-19(25)2-1-9-26-22/h1-9,14H,10-13,15H2
InChIKeyYMECVQODKXMJDZ-UHFFFAOYSA-N
MW422.89 g/mol
LogP4.69
Rot. Bonds4

About 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine

4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine (PubChem CID 121309794) has the molecular formula C23H20ClFN4O and a molecular weight of 422.89 g/mol. Its IUPAC name is 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
PubChem CID121309794
Molecular FormulaC23H20ClFN4O
Molecular Weight422.89 g/mol
Exact Mass422.13
IUPAC Name4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
SMILESFc1cccnc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1
InChIInChI=1S/C23H20ClFN4O/c24-18-6-3-16(4-7-18)23-20(15-28-10-12-30-13-11-28)29-14-17(5-8-21(29)27-23)22-19(25)2-1-9-26-22/h1-9,14H,10-13,15H2
InChIKeyYMECVQODKXMJDZ-UHFFFAOYSA-N
XLogP4.69
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.89
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?
The IUPAC name of 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine (CID 121309794) is 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine.
What is the SMILES notation for 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?
The canonical SMILES for 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine is Fc1cccnc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.
What is the InChIKey of 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?
The InChIKey is YMECVQODKXMJDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClFN4O/c24-18-6-3-16(4-7-18)23-20(15-28-10-12-30-13-11-28)29-14-17(5-8-21(29)27-23)22-19(25)2-1-9-26-22/h1-9,14H,10-13,15H2.
What are the key properties of 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?
4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine has a molecular weight of 422.89 g/mol, XLogP of 4.69, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-chlorophenyl)-6-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine is sourced from PubChem (CID 121309794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).