1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide

C22H26N4O2 — CID 47069261

IUPAC1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide
SMILESO=C(Nc1cccc(N2CCNC2=O)c1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C22H26N4O2/c27-21(18-8-5-12-25(16-18)15-17-6-2-1-3-7-17)24-19-9-4-10-20(14-19)26-13-11-23-22(26)28/h1-4,6-7,9-10,14,18H,5,8,11-13,15-16H2,(H,23,28)(H,24,27)
InChIKeyRCBRIEPUKMFLBH-UHFFFAOYSA-N
MW378.48 g/mol
LogP3.07
Rot. Bonds5

About 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide

1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide (PubChem CID 47069261) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide
PubChem CID47069261
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC Name1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide
SMILESO=C(Nc1cccc(N2CCNC2=O)c1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C22H26N4O2/c27-21(18-8-5-12-25(16-18)15-17-6-2-1-3-7-17)24-19-9-4-10-20(14-19)26-13-11-23-22(26)28/h1-4,6-7,9-10,14,18H,5,8,11-13,15-16H2,(H,23,28)(H,24,27)
InChIKeyRCBRIEPUKMFLBH-UHFFFAOYSA-N
XLogP3.07
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-[3-(2-oxoimidazolidin-1-yl)phenyl]-1-N-phenylpiperidine-1,3-dicarboxamide
CID 55717175
1-benzyl-N-[3-(phenylcarbamoylamino)phenyl]piperidine-3-carboxamide
CID 47074842
(3S)-1-benzyl-N-(3-chlorophenyl)piperidine-3-carboxamide
CID 93490524
(3R)-1-benzyl-N-(3-chlorophenyl)piperidine-3-carboxamide
CID 93490525
4-[[3-(2-oxoimidazolidin-1-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120672792
1-[(3S,4S)-1-benzyl-3-methylpiperidin-4-yl]-1-methyl-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 96533752
1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
CID 43925060
1-benzyl-N-[3-(ethylaminomethyl)phenyl]piperidine-3-carboxamide;dihydrochloride
CID 119438547
(3S)-1-benzyl-N-(3,4-dimethylphenyl)piperidine-3-carboxamide
CID 93490442
1-benzyl-N-[3-(cyclopropylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 60562957
1-benzyl-N-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide
CID 60563034
N-[3-(cyclopropanecarbonylamino)phenyl]-1-[(3-fluorophenyl)methyl]piperidine-3-carboxamide
CID 47805198

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide?
The IUPAC name of 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide (CID 47069261) is 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide is O=C(Nc1cccc(N2CCNC2=O)c1)C1CCCN(Cc2ccccc2)C1.
What is the InChIKey of 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide?
The InChIKey is RCBRIEPUKMFLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c27-21(18-8-5-12-25(16-18)15-17-6-2-1-3-7-17)24-19-9-4-10-20(14-19)26-13-11-23-22(26)28/h1-4,6-7,9-10,14,18H,5,8,11-13,15-16H2,(H,23,28)(H,24,27).
What are the key properties of 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide?
1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide has a molecular weight of 378.48 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 47069261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).