1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide

C17H19N3O3 — CID 17311929

IUPAC1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide
SMILESCc1onc(-c2ccccc2)c1C(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C17H19N3O3/c1-11-14(15(19-23-11)12-5-3-2-4-6-12)17(22)20-9-7-13(8-10-20)16(18)21/h2-6,13H,7-10H2,1H3,(H2,18,21)
InChIKeyHHOMFMMELDHXQQ-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.99
Rot. Bonds3

About 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide

1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide (PubChem CID 17311929) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide
PubChem CID17311929
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide
SMILESCc1onc(-c2ccccc2)c1C(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C17H19N3O3/c1-11-14(15(19-23-11)12-5-3-2-4-6-12)17(22)20-9-7-13(8-10-20)16(18)21/h2-6,13H,7-10H2,1H3,(H2,18,21)
InChIKeyHHOMFMMELDHXQQ-UHFFFAOYSA-N
XLogP1.99
TPSA89.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide (CID 17311929) is 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide is Cc1onc(-c2ccccc2)c1C(=O)N1CCC(C(N)=O)CC1.
What is the InChIKey of 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide?
The InChIKey is HHOMFMMELDHXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-11-14(15(19-23-11)12-5-3-2-4-6-12)17(22)20-9-7-13(8-10-20)16(18)21/h2-6,13H,7-10H2,1H3,(H2,18,21).
What are the key properties of 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide?
1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 17311929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).