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

C16H17N3O3 — CID 1093757

IUPAC1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2cc(-c3ccccc3)on2)CC1
InChIInChI=1S/C16H17N3O3/c17-15(20)12-6-8-19(9-7-12)16(21)13-10-14(22-18-13)11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H2,17,20)
InChIKeyAZIDAIPMLWSEPN-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.68
Rot. Bonds3

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

1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide (PubChem CID 1093757) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide
PubChem CID1093757
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2cc(-c3ccccc3)on2)CC1
InChIInChI=1S/C16H17N3O3/c17-15(20)12-6-8-19(9-7-12)16(21)13-10-14(22-18-13)11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H2,17,20)
InChIKeyAZIDAIPMLWSEPN-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

[1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]-piperidin-1-ylmethanone
CID 51264852
[1-[5-(4-chlorophenyl)-1,2-oxazole-3-carbonyl]piperidin-4-yl]-phenylmethanone
CID 24682971
[(3R,4S)-3,4-dihydroxypyrrolidin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 79410077
(3S)-1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-3-carboxylic acid
CID 119113731
N-(5-methyl-2-pyridinyl)-1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide
CID 55810051
1-(2-phenyl-1,3-oxazole-4-carbonyl)piperidine-4-carboxamide
CID 119137409
[4-(4-chlorophenoxy)piperidin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 67169320
4-hydroxy-1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxylic acid
CID 119251838
[4-(5-methyl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 110619740
[4-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 110313558
(5-phenyl-1,2-oxazol-3-yl)-(7-thiophen-2-yl-1,4-thiazepan-4-yl)methanone
CID 90632787
2-[3-[1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]-1H-pyrazol-5-yl]acetic acid
CID 56710651

Frequently Asked Questions

What is the IUPAC name of 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide (CID 1093757) is 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)c2cc(-c3ccccc3)on2)CC1.
What is the InChIKey of 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide?
The InChIKey is AZIDAIPMLWSEPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c17-15(20)12-6-8-19(9-7-12)16(21)13-10-14(22-18-13)11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H2,17,20).
What are the key properties of 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide?
1-(5-phenyl-1,2-oxazole-3-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-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 1093757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).