(3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone

C14H15N3O3 — CID 110899930

IUPAC(3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone
SMILESO=C(c1cc(-c2ccncc2)on1)N1CCCC(O)C1
InChIInChI=1S/C14H15N3O3/c18-11-2-1-7-17(9-11)14(19)12-8-13(20-16-12)10-3-5-15-6-4-10/h3-6,8,11,18H,1-2,7,9H2
InChIKeyDARPGDOIXPQYEJ-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.33
Rot. Bonds2

About (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone

(3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone (PubChem CID 110899930) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone.

Molecular Properties

Compound Name(3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone
PubChem CID110899930
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name(3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone
SMILESO=C(c1cc(-c2ccncc2)on1)N1CCCC(O)C1
InChIInChI=1S/C14H15N3O3/c18-11-2-1-7-17(9-11)14(19)12-8-13(20-16-12)10-3-5-15-6-4-10/h3-6,8,11,18H,1-2,7,9H2
InChIKeyDARPGDOIXPQYEJ-UHFFFAOYSA-N
XLogP1.33
TPSA79.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,9-diazabicyclo[4.2.1]nonan-3-yl-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone
CID 119639120
(3S)-1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-3-carboxylic acid
CID 119113731
[4-(5-pyridin-4-yl-1,2-oxazole-3-carbonyl)piperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CID 112838896
[4-(ethylaminomethyl)piperidin-1-yl]-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone
CID 119648082
[(3S)-3-anilinopiperidin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 42292828
[5-(4-cyclohexylphenyl)-1,2-oxazol-3-yl]-[(3S)-3-methylpiperidin-1-yl]methanone
CID 92758389
[(3R)-3-anilinopiperidin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 42292827
[(3R,4S)-3,4-dihydroxypyrrolidin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 79410077
[5-(furan-2-yl)-1,2-oxazol-3-yl]-(3-pyridin-4-yloxypiperidin-1-yl)methanone
CID 122255659
1-[5-(4-methylphenyl)-1,2-oxazole-3-carbonyl]-N-propan-2-ylpiperidine-3-carboxamide
CID 91953801
[2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone
CID 126774607
azepan-1-yl-[5-(4-hydroxyphenyl)-1,2-oxazol-3-yl]methanone
CID 135573124

Frequently Asked Questions

What is the IUPAC name of (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone?
The IUPAC name of (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone (CID 110899930) is (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone.
What is the SMILES notation for (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone?
The canonical SMILES for (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone is O=C(c1cc(-c2ccncc2)on1)N1CCCC(O)C1.
What is the InChIKey of (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone?
The InChIKey is DARPGDOIXPQYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c18-11-2-1-7-17(9-11)14(19)12-8-13(20-16-12)10-3-5-15-6-4-10/h3-6,8,11,18H,1-2,7,9H2.
What are the key properties of (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone?
(3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone has a molecular weight of 273.29 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-hydroxypiperidin-1-yl)-(5-pyridin-4-yl-1,2-oxazol-3-yl)methanone is sourced from PubChem (CID 110899930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).