furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone

C20H23N5O2 — CID 97362299

IUPACfuran-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCC(c2nc3ccc(N4CCCC4)cn3n2)CC1
InChIInChI=1S/C20H23N5O2/c26-20(17-4-3-13-27-17)24-11-7-15(8-12-24)19-21-18-6-5-16(14-25(18)22-19)23-9-1-2-10-23/h3-6,13-15H,1-2,7-12H2
InChIKeyJWNYSIAGLGLHDR-UHFFFAOYSA-N
MW365.44 g/mol
LogP2.94
Rot. Bonds3

About furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone

furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone (PubChem CID 97362299) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone
PubChem CID97362299
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC Namefuran-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCC(c2nc3ccc(N4CCCC4)cn3n2)CC1
InChIInChI=1S/C20H23N5O2/c26-20(17-4-3-13-27-17)24-11-7-15(8-12-24)19-21-18-6-5-16(14-25(18)22-19)23-9-1-2-10-23/h3-6,13-15H,1-2,7-12H2
InChIKeyJWNYSIAGLGLHDR-UHFFFAOYSA-N
XLogP2.94
TPSA66.88 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone (CID 97362299) is furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone is O=C(c1ccco1)N1CCC(c2nc3ccc(N4CCCC4)cn3n2)CC1.
What is the InChIKey of furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone?
The InChIKey is JWNYSIAGLGLHDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c26-20(17-4-3-13-27-17)24-11-7-15(8-12-24)19-21-18-6-5-16(14-25(18)22-19)23-9-1-2-10-23/h3-6,13-15H,1-2,7-12H2.
What are the key properties of furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone?
furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone has a molecular weight of 365.44 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 97362299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).