5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole

C19H25N3O2 — CID 10149830

IUPAC5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole
SMILESc1ccc(OC2CNCC(C3CCNCC3)C2c2cnco2)cc1
InChIInChI=1S/C19H25N3O2/c1-2-4-15(5-3-1)24-18-12-21-10-16(14-6-8-20-9-7-14)19(18)17-11-22-13-23-17/h1-5,11,13-14,16,18-21H,6-10,12H2
InChIKeyFPJGFYOEOGKMDJ-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.42
Rot. Bonds4

About 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole

5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole (PubChem CID 10149830) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole.

Molecular Properties

Compound Name5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole
PubChem CID10149830
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole
SMILESc1ccc(OC2CNCC(C3CCNCC3)C2c2cnco2)cc1
InChIInChI=1S/C19H25N3O2/c1-2-4-15(5-3-1)24-18-12-21-10-16(14-6-8-20-9-7-14)19(18)17-11-22-13-23-17/h1-5,11,13-14,16,18-21H,6-10,12H2
InChIKeyFPJGFYOEOGKMDJ-UHFFFAOYSA-N
XLogP2.42
TPSA59.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-phenoxypiperidin-4-amine
CID 91441507
4-phenoxypyrrolidine-3-thiol
CID 130451524
3-phenoxy-4-propan-2-ylpyrrolidine
CID 130439582
3-[(3R,4S)-3-fluoropiperidin-4-yl]oxypyridine
CID 129278225
bis(4-phenoxypyrrolidin-3-yl) (E)-but-2-enedioate
CID 70454311
(1R,5S)-2-phenoxy-6-oxabicyclo[3.1.0]hexane
CID 54108121
2,3-difluoro-4-phenoxypiperidine
CID 129282213
3-piperidin-4-yloxypyridine;dihydrochloride
CID 22989727
4-methyl-3-(3-phenoxypropoxy)piperidine
CID 102954189
(3R)-3-phenoxypiperidine
CID 42553363
(E)-but-2-enedioic acid;(3S,4S)-3-methoxy-4-phenoxypyrrolidine
CID 70454058
(3R,4R)-4-(4-bromophenoxy)-3-phenylpiperidine
CID 13039290

Frequently Asked Questions

What is the IUPAC name of 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole?
The IUPAC name of 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole (CID 10149830) is 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole.
What is the SMILES notation for 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole?
The canonical SMILES for 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole is c1ccc(OC2CNCC(C3CCNCC3)C2c2cnco2)cc1.
What is the InChIKey of 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole?
The InChIKey is FPJGFYOEOGKMDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-2-4-15(5-3-1)24-18-12-21-10-16(14-6-8-20-9-7-14)19(18)17-11-22-13-23-17/h1-5,11,13-14,16,18-21H,6-10,12H2.
What are the key properties of 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole?
5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole has a molecular weight of 327.43 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-phenoxy-5-piperidin-4-ylpiperidin-4-yl)-1,3-oxazole is sourced from PubChem (CID 10149830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).