N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide

C22H24N4O2 — CID 86913250

IUPACN-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide
SMILESCC(c1nc(-c2ccccc2)no1)N1CCCC(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C22H24N4O2/c1-16(22-24-20(25-28-22)17-9-4-2-5-10-17)26-14-8-11-18(15-26)21(27)23-19-12-6-3-7-13-19/h2-7,9-10,12-13,16,18H,8,11,14-15H2,1H3,(H,23,27)
InChIKeyQFXBKBMZGNGCJD-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.15
Rot. Bonds5

About N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide

N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide (PubChem CID 86913250) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide
PubChem CID86913250
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC NameN-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide
SMILESCC(c1nc(-c2ccccc2)no1)N1CCCC(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C22H24N4O2/c1-16(22-24-20(25-28-22)17-9-4-2-5-10-17)26-14-8-11-18(15-26)21(27)23-19-12-6-3-7-13-19/h2-7,9-10,12-13,16,18H,8,11,14-15H2,1H3,(H,23,27)
InChIKeyQFXBKBMZGNGCJD-UHFFFAOYSA-N
XLogP4.15
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-phenyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
CID 43929041
1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-4-carboxylic acid;hydrochloride
CID 119907313
N-cyclopropyl-1-[(1S)-1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-4-carboxamide
CID 94651886
(4-methylphenyl)-[1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-4-yl]methanone
CID 87034801
N-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]cyclohexanecarboxamide
CID 6458644
1-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-phenylpiperidine-3-carboxamide
CID 43933224
[4-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]-piperidin-3-ylmethanone;dihydrochloride
CID 119857090
1-[3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoyl]-N-phenylpiperidine-3-carboxamide
CID 134011729
(3S)-1-[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-N-phenylpiperidine-3-carboxamide
CID 51500739
2-[4-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 55432670
3-[4-[1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]piperazin-1-yl]-N-phenylpropanamide
CID 46406200
2-[4-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]acetic acid
CID 119924431

Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide?
The IUPAC name of N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide (CID 86913250) is N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide?
The canonical SMILES for N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide is CC(c1nc(-c2ccccc2)no1)N1CCCC(C(=O)Nc2ccccc2)C1.
What is the InChIKey of N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide?
The InChIKey is QFXBKBMZGNGCJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-16(22-24-20(25-28-22)17-9-4-2-5-10-17)26-14-8-11-18(15-26)21(27)23-19-12-6-3-7-13-19/h2-7,9-10,12-13,16,18H,8,11,14-15H2,1H3,(H,23,27).
What are the key properties of N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide?
N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1-[1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 86913250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).