5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole

C20H22N4O2 — CID 118675997

IUPAC5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole
SMILESCc1cc(CN2CCC(Oc3cccnc3-c3ccncc3)CC2)no1
InChIInChI=1S/C20H22N4O2/c1-15-13-17(23-26-15)14-24-11-6-18(7-12-24)25-19-3-2-8-22-20(19)16-4-9-21-10-5-16/h2-5,8-10,13,18H,6-7,11-12,14H2,1H3
InChIKeyCSGCJZASYPRBOE-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.48
Rot. Bonds5

About 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole

5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole (PubChem CID 118675997) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole.

Molecular Properties

Compound Name5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole
PubChem CID118675997
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole
SMILESCc1cc(CN2CCC(Oc3cccnc3-c3ccncc3)CC2)no1
InChIInChI=1S/C20H22N4O2/c1-15-13-17(23-26-15)14-24-11-6-18(7-12-24)25-19-3-2-8-22-20(19)16-4-9-21-10-5-16/h2-5,8-10,13,18H,6-7,11-12,14H2,1H3
InChIKeyCSGCJZASYPRBOE-UHFFFAOYSA-N
XLogP3.48
TPSA64.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole with MolForge

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Launch Full Analysis

Related Compounds

4-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazole
CID 118675977
3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]oxy-2-pyridin-4-ylpyridine
CID 118675992
5-methyl-3-[[4-(1,3-thiazol-2-yloxy)piperidin-1-yl]methyl]-1,2-oxazole
CID 163345490
cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
CID 118676010
5-methyl-3-[[4-(1-propan-2-yl-4-pyridin-3-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]methyl]-1,2-oxazole
CID 97447652
4-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]sulfonylmorpholine
CID 118675921
2-methyl-N-[[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]methyl]propan-2-amine
CID 55256260
3-[[4-(2-methylphenoxy)piperidin-1-yl]methyl]pyridine
CID 56892936
1-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrrolidin-3-ol
CID 62917538
4-[[4-(4-methylphenoxy)piperidin-1-yl]methyl]pyridine
CID 90245740
(4R)-4-[2-[(3-fluoro-2-pyridinyl)oxy]ethyl]-8-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-oxa-8-azaspiro[4.5]decane
CID 124797764
3-[[3-(4-fluorophenyl)pyrrolidin-1-yl]methyl]-5-methyl-1,2-oxazole
CID 172891629

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole?
The IUPAC name of 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole (CID 118675997) is 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole.
What is the SMILES notation for 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole?
The canonical SMILES for 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole is Cc1cc(CN2CCC(Oc3cccnc3-c3ccncc3)CC2)no1.
What is the InChIKey of 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole?
The InChIKey is CSGCJZASYPRBOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-15-13-17(23-26-15)14-24-11-6-18(7-12-24)25-19-3-2-8-22-20(19)16-4-9-21-10-5-16/h2-5,8-10,13,18H,6-7,11-12,14H2,1H3.
What are the key properties of 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole?
5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole has a molecular weight of 350.42 g/mol, XLogP of 3.48, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[[4-[(2-pyridin-4-yl-3-pyridinyl)oxy]piperidin-1-yl]methyl]-1,2-oxazole is sourced from PubChem (CID 118675997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).