4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine

C24H20F2N4O2 — CID 57449784

IUPAC4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine
SMILESCc1c(-c2ccccn2)nc2cc(F)cc(F)c2c1Oc1cncc(N2CCOCC2)c1
InChIInChI=1S/C24H20F2N4O2/c1-15-23(20-4-2-3-5-28-20)29-21-11-16(25)10-19(26)22(21)24(15)32-18-12-17(13-27-14-18)30-6-8-31-9-7-30/h2-5,10-14H,6-9H2,1H3
InChIKeyZDGPXZDDZQTUMF-UHFFFAOYSA-N
MW434.45 g/mol
LogP4.91
Rot. Bonds4

About 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine

4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine (PubChem CID 57449784) has the molecular formula C24H20F2N4O2 and a molecular weight of 434.45 g/mol. Its IUPAC name is 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine
PubChem CID57449784
Molecular FormulaC24H20F2N4O2
Molecular Weight434.45 g/mol
Exact Mass434.16
IUPAC Name4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine
SMILESCc1c(-c2ccccn2)nc2cc(F)cc(F)c2c1Oc1cncc(N2CCOCC2)c1
InChIInChI=1S/C24H20F2N4O2/c1-15-23(20-4-2-3-5-28-20)29-21-11-16(25)10-19(26)22(21)24(15)32-18-12-17(13-27-14-18)30-6-8-31-9-7-30/h2-5,10-14H,6-9H2,1H3
InChIKeyZDGPXZDDZQTUMF-UHFFFAOYSA-N
XLogP4.91
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.45
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine?
The IUPAC name of 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine (CID 57449784) is 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine?
The canonical SMILES for 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine is Cc1c(-c2ccccn2)nc2cc(F)cc(F)c2c1Oc1cncc(N2CCOCC2)c1.
What is the InChIKey of 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine?
The InChIKey is ZDGPXZDDZQTUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F2N4O2/c1-15-23(20-4-2-3-5-28-20)29-21-11-16(25)10-19(26)22(21)24(15)32-18-12-17(13-27-14-18)30-6-8-31-9-7-30/h2-5,10-14H,6-9H2,1H3.
What are the key properties of 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine?
4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine has a molecular weight of 434.45 g/mol, XLogP of 4.91, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)oxy-3-pyridinyl]morpholine is sourced from PubChem (CID 57449784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).