4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine

C22H26FN5O — CID 131669076

IUPAC4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
SMILESFc1cccc(CN2CCCC(c3nc4ccc(N5CCOCC5)cn4n3)C2)c1
InChIInChI=1S/C22H26FN5O/c23-19-5-1-3-17(13-19)14-26-8-2-4-18(15-26)22-24-21-7-6-20(16-28(21)25-22)27-9-11-29-12-10-27/h1,3,5-7,13,16,18H,2,4,8-12,14-15H2
InChIKeyGPOBOMGBLQRGEU-UHFFFAOYSA-N
MW395.48 g/mol
LogP3.08
Rot. Bonds4

About 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine

4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine (PubChem CID 131669076) has the molecular formula C22H26FN5O and a molecular weight of 395.48 g/mol. Its IUPAC name is 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine.

Molecular Properties

Compound Name4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
PubChem CID131669076
Molecular FormulaC22H26FN5O
Molecular Weight395.48 g/mol
Exact Mass395.21
IUPAC Name4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
SMILESFc1cccc(CN2CCCC(c3nc4ccc(N5CCOCC5)cn4n3)C2)c1
InChIInChI=1S/C22H26FN5O/c23-19-5-1-3-17(13-19)14-26-8-2-4-18(15-26)22-24-21-7-6-20(16-28(21)25-22)27-9-11-29-12-10-27/h1,3,5-7,13,16,18H,2,4,8-12,14-15H2
InChIKeyGPOBOMGBLQRGEU-UHFFFAOYSA-N
XLogP3.08
TPSA45.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.48
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[2-[1-[(3-methylphenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine;2,2,2-trifluoroacetic acid
CID 171695279
4-[2-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine;bis(2,2,2-trifluoroacetic acid)
CID 155826344
4-[2-[1-[(4-ethylphenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine;2,2,2-trifluoroacetic acid
CID 171695440
4-[2-[1-[(4-fluorophenyl)methyl]pyrrolidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine;2,2,2-trifluoroacetic acid
CID 171695646
4-[2-[1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
CID 131669080
4-[2-[1-[(6-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
CID 131670840
2-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]-6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 131669042
4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
CID 97362315
4-[2-[1-[(3-methylthiophen-2-yl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine;bis(2,2,2-trifluoroacetic acid)
CID 155848353
4-[2-[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine;2,2,2-trifluoroacetic acid
CID 171693406
[3-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]-pyridin-4-ylmethanone
CID 131669075
4-[2-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
CID 97362314

Frequently Asked Questions

What is the IUPAC name of 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine?
The IUPAC name of 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine (CID 131669076) is 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine.
What is the SMILES notation for 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine?
The canonical SMILES for 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine is Fc1cccc(CN2CCCC(c3nc4ccc(N5CCOCC5)cn4n3)C2)c1.
What is the InChIKey of 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine?
The InChIKey is GPOBOMGBLQRGEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26FN5O/c23-19-5-1-3-17(13-19)14-26-8-2-4-18(15-26)22-24-21-7-6-20(16-28(21)25-22)27-9-11-29-12-10-27/h1,3,5-7,13,16,18H,2,4,8-12,14-15H2.
What are the key properties of 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine?
4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine has a molecular weight of 395.48 g/mol, XLogP of 3.08, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine is sourced from PubChem (CID 131669076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).