3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide

C19H23N3O2 — CID 167926953

IUPAC3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide
SMILESO=C(Nc1cccc(N2CCCCC2)c1)c1conc1C1CCC1
InChIInChI=1S/C19H23N3O2/c23-19(17-13-24-21-18(17)14-6-4-7-14)20-15-8-5-9-16(12-15)22-10-2-1-3-11-22/h5,8-9,12-14H,1-4,6-7,10-11H2,(H,20,23)
InChIKeyVEAVRYHNHXPDDW-UHFFFAOYSA-N
MW325.41 g/mol
LogP4.18
Rot. Bonds4

About 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide

3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide (PubChem CID 167926953) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide
PubChem CID167926953
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide
SMILESO=C(Nc1cccc(N2CCCCC2)c1)c1conc1C1CCC1
InChIInChI=1S/C19H23N3O2/c23-19(17-13-24-21-18(17)14-6-4-7-14)20-15-8-5-9-16(12-15)22-10-2-1-3-11-22/h5,8-9,12-14H,1-4,6-7,10-11H2,(H,20,23)
InChIKeyVEAVRYHNHXPDDW-UHFFFAOYSA-N
XLogP4.18
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-(3-pyrrolidin-1-ylphenyl)benzamide
CID 28987913
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3-chloro-N-(3-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 66462445
4-amino-N-(3-pyrrolidin-1-ylphenyl)-1,2,5-oxadiazole-3-carboxamide
CID 62688150
5-cyclopropyl-1-(2,4-dichlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)pyrazole-4-carboxamide
CID 55877479
2-methyl-N-(3-piperidin-1-ylphenyl)quinoline-3-carboxamide
CID 86832456
methyl N-(3-piperidin-1-ylphenyl)carbamate
CID 110362130
5-bromo-1-phenyl-N-(3-pyrrolidin-1-ylphenyl)pyrazole-4-carboxamide
CID 75453052
N-(3-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide
CID 60928576
N-(3-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
CID 47255294
2-chloro-N-(3-piperidin-1-ylphenyl)acetamide
CID 43822445
2-amino-N-[3-(azepan-1-yl)phenyl]acetamide
CID 119892163

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide (CID 167926953) is 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide is O=C(Nc1cccc(N2CCCCC2)c1)c1conc1C1CCC1.
What is the InChIKey of 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide?
The InChIKey is VEAVRYHNHXPDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c23-19(17-13-24-21-18(17)14-6-4-7-14)20-15-8-5-9-16(12-15)22-10-2-1-3-11-22/h5,8-9,12-14H,1-4,6-7,10-11H2,(H,20,23).
What are the key properties of 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide?
3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-N-(3-piperidin-1-ylphenyl)-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 167926953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).