6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide

C15H18N4O2 — CID 91651046

IUPAC6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1c1noc(-c2ccccc2)n1
InChIInChI=1S/C15H18N4O2/c1-10-7-8-12(13(16)20)9-19(10)15-17-14(21-18-15)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3,(H2,16,20)
InChIKeyPKOAJCNMYFOIDM-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.83
Rot. Bonds3

About 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide

6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide (PubChem CID 91651046) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide
PubChem CID91651046
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1c1noc(-c2ccccc2)n1
InChIInChI=1S/C15H18N4O2/c1-10-7-8-12(13(16)20)9-19(10)15-17-14(21-18-15)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3,(H2,16,20)
InChIKeyPKOAJCNMYFOIDM-UHFFFAOYSA-N
XLogP1.83
TPSA85.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3R,6R)-6-methyl-1-(3-phenyl-1,2-oxazole-5-carbonyl)piperidine-3-carboxamide
CID 95585010
(3S,6R)-1-(1,3-benzoxazol-2-yl)-6-methylpiperidine-3-carboxamide
CID 94196147
1-(4-cyanopyrimidin-2-yl)-6-methylpiperidine-3-carboxamide
CID 107544065
(3aS,5R,6R,7aR)-2-(5-phenyl-1,2,4-oxadiazol-3-yl)-1,3,3a,4,5,6,7,7a-octahydroisoindole-5,6-diol
CID 133112625
1-(3-amino-6-methyl-2-pyridinyl)-6-methylpiperidine-3-carboxamide
CID 81131851
1-(4-carbamothioyl-3-pyridinyl)-6-methylpiperidine-3-carboxamide
CID 114288364
[1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
CID 133481699
(3S)-1-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrrolidin-3-amine
CID 59028714
1-[5-(3,5-dichlorophenyl)-1,2,4-oxadiazol-3-yl]piperidine-3-carboxamide
CID 126827300
1-[4-(dimethylamino)-6-(trifluoromethyl)pyrimidin-2-yl]-6-methylpiperidine-3-carboxamide
CID 133271070
(3S,6S)-1-(4-bromo-2-pyridinyl)-6-methylpiperidine-3-carboxamide
CID 99857715
4-(5-carbamoyl-2-methylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 54988866

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide?
The IUPAC name of 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide (CID 91651046) is 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide.
What is the SMILES notation for 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide?
The canonical SMILES for 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide is CC1CCC(C(N)=O)CN1c1noc(-c2ccccc2)n1.
What is the InChIKey of 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide?
The InChIKey is PKOAJCNMYFOIDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-10-7-8-12(13(16)20)9-19(10)15-17-14(21-18-15)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3,(H2,16,20).
What are the key properties of 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide?
6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)piperidine-3-carboxamide is sourced from PubChem (CID 91651046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).