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

C16H17N3O3 — CID 119137409

IUPAC1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2coc(-c3ccccc3)n2)CC1
InChIInChI=1S/C16H17N3O3/c17-14(20)11-6-8-19(9-7-11)16(21)13-10-22-15(18-13)12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H2,17,20)
InChIKeyAHRZVXNNFMWHRC-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.68
Rot. Bonds3

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

1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide (PubChem CID 119137409) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide
PubChem CID119137409
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2coc(-c3ccccc3)n2)CC1
InChIInChI=1S/C16H17N3O3/c17-14(20)11-6-8-19(9-7-11)16(21)13-10-22-15(18-13)12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H2,17,20)
InChIKeyAHRZVXNNFMWHRC-UHFFFAOYSA-N
XLogP1.68
TPSA89.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(1-aminoethyl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-4-yl)methanone;hydrochloride
CID 119520922
[4-(cyclopropylmethylamino)piperidin-1-yl]-(2-phenyl-1,3-oxazol-4-yl)methanone
CID 119625411
ethyl 4-(2-phenyl-1,3-oxazole-4-carbonyl)piperazine-1-carboxylate
CID 46896218
1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide
CID 1093757
1-[2-(3,4-dichlorophenyl)-1,3-oxazole-4-carbonyl]piperidine-4-carboxylic acid
CID 84557942
(2-phenyl-1,3-oxazol-4-yl)-(3-piperazin-1-ylpyrrolidin-1-yl)methanone
CID 120996015
[3-(methylaminomethyl)pyrrolidin-1-yl]-(2-phenyl-1,3-oxazol-4-yl)methanone
CID 119542389
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-(2-phenyl-1,3-oxazol-4-yl)methanone
CID 120659449
[3-(methylamino)piperidin-1-yl]-(2-phenyl-1,3-oxazol-4-yl)methanone;hydrochloride
CID 119493804
(2S,4R)-4-fluoro-1-(2-phenyl-1,3-oxazole-4-carbonyl)pyrrolidine-2-carboxamide
CID 120965545
3-fluoro-1-(2-phenyl-1,3-oxazole-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 119258590
(3S,4S)-1-(2-phenyl-1,3-oxazole-4-carbonyl)-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 120949165

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide (CID 119137409) is 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)c2coc(-c3ccccc3)n2)CC1.
What is the InChIKey of 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide?
The InChIKey is AHRZVXNNFMWHRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c17-14(20)11-6-8-19(9-7-11)16(21)13-10-22-15(18-13)12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H2,17,20).
What are the key properties of 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide?
1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 119137409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).