N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide

C15H18N4O2 — CID 106396970

IUPACN-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide
SMILESO=C(NCc1ncon1)C1(c2ccccc2)CCNCC1
InChIInChI=1S/C15H18N4O2/c20-14(17-10-13-18-11-21-19-13)15(6-8-16-9-7-15)12-4-2-1-3-5-12/h1-5,11,16H,6-10H2,(H,17,20)
InChIKeyRZTAHZJMIXCMHL-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.01
Rot. Bonds4

About N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide

N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide (PubChem CID 106396970) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide
PubChem CID106396970
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC NameN-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide
SMILESO=C(NCc1ncon1)C1(c2ccccc2)CCNCC1
InChIInChI=1S/C15H18N4O2/c20-14(17-10-13-18-11-21-19-13)15(6-8-16-9-7-15)12-4-2-1-3-5-12/h1-5,11,16H,6-10H2,(H,17,20)
InChIKeyRZTAHZJMIXCMHL-UHFFFAOYSA-N
XLogP1.01
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,2,4-oxadiazol-3-ylmethyl)-3-propylpyrrolidine-3-carboxamide
CID 106396912
1-(1,2,4-oxadiazol-3-ylmethylcarbamoyl)cyclobutane-1-carboxylic acid
CID 106406108
N-(2-hydroxy-2-methylpropyl)-4-phenylpiperidine-4-carboxamide
CID 65106988
N-(3,3-dimethylbutyl)-4-phenylpiperidine-4-carboxamide
CID 115597355
4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide
CID 70118904
N-ethylsulfonyl-4-phenylpiperidine-4-carboxamide
CID 103307088
1-phenyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 30944923
1-cyano-N-(1,2,4-oxadiazol-3-ylmethyl)cyclobutane-1-carboxamide
CID 106398598
N-[(4-fluorophenyl)methyl]-1-phenylcyclopropane-1-carboxamide
CID 2540117
N-(5-bromopyrimidin-2-yl)-4-phenylpiperidine-4-carboxamide
CID 66981335
N-[(3S)-3-methylsulfanylbutyl]-4-phenylpiperidine-4-carboxamide
CID 124575017
(2R)-3-hydroxy-2-[(4-phenylpiperidine-4-carbonyl)amino]propanoic acid
CID 80756050

Frequently Asked Questions

What is the IUPAC name of N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide?
The IUPAC name of N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide (CID 106396970) is N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide.
What is the SMILES notation for N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide?
The canonical SMILES for N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide is O=C(NCc1ncon1)C1(c2ccccc2)CCNCC1.
What is the InChIKey of N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide?
The InChIKey is RZTAHZJMIXCMHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c20-14(17-10-13-18-11-21-19-13)15(6-8-16-9-7-15)12-4-2-1-3-5-12/h1-5,11,16H,6-10H2,(H,17,20).
What are the key properties of N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide?
N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,4-oxadiazol-3-ylmethyl)-4-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 106396970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).