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

C20H25N5O2 — CID 97362315

IUPAC4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
SMILESc1cc(CN2CCC(c3nc4ccc(N5CCOCC5)cn4n3)CC2)co1
InChIInChI=1S/C20H25N5O2/c1-2-19-21-20(22-25(19)14-18(1)24-8-11-26-12-9-24)17-3-6-23(7-4-17)13-16-5-10-27-15-16/h1-2,5,10,14-15,17H,3-4,6-9,11-13H2
InChIKeyKAAGVDGJJXYIFU-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.54
Rot. Bonds4

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

4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine (PubChem CID 97362315) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine.

Molecular Properties

Compound Name4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
PubChem CID97362315
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine
SMILESc1cc(CN2CCC(c3nc4ccc(N5CCOCC5)cn4n3)CC2)co1
InChIInChI=1S/C20H25N5O2/c1-2-19-21-20(22-25(19)14-18(1)24-8-11-26-12-9-24)17-3-6-23(7-4-17)13-16-5-10-27-15-16/h1-2,5,10,14-15,17H,3-4,6-9,11-13H2
InChIKeyKAAGVDGJJXYIFU-UHFFFAOYSA-N
XLogP2.54
TPSA59.04 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine?
The IUPAC name of 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine (CID 97362315) is 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine.
What is the SMILES notation for 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine?
The canonical SMILES for 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine is c1cc(CN2CCC(c3nc4ccc(N5CCOCC5)cn4n3)CC2)co1.
What is the InChIKey of 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine?
The InChIKey is KAAGVDGJJXYIFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c1-2-19-21-20(22-25(19)14-18(1)24-8-11-26-12-9-24)17-3-6-23(7-4-17)13-16-5-10-27-15-16/h1-2,5,10,14-15,17H,3-4,6-9,11-13H2.
What are the key properties of 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine?
4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine has a molecular weight of 367.45 g/mol, XLogP of 2.54, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-(furan-3-ylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]morpholine is sourced from PubChem (CID 97362315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).