4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide

C21H31N5O2 — CID 136521525

IUPAC4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide
SMILESO=C(NCc1ccccc1N1CCCCC1)N1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C21H31N5O2/c27-20(25-13-8-18(9-14-25)26-15-10-22-21(26)28)23-16-17-6-2-3-7-19(17)24-11-4-1-5-12-24/h2-3,6-7,18H,1,4-5,8-16H2,(H,22,28)(H,23,27)
InChIKeyUCZAPCYTEDXLBT-UHFFFAOYSA-N
MW385.51 g/mol
LogP2.38
Rot. Bonds4

About 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide

4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide (PubChem CID 136521525) has the molecular formula C21H31N5O2 and a molecular weight of 385.51 g/mol. Its IUPAC name is 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide
PubChem CID136521525
Molecular FormulaC21H31N5O2
Molecular Weight385.51 g/mol
Exact Mass385.25
IUPAC Name4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide
SMILESO=C(NCc1ccccc1N1CCCCC1)N1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C21H31N5O2/c27-20(25-13-8-18(9-14-25)26-15-10-22-21(26)28)23-16-17-6-2-3-7-19(17)24-11-4-1-5-12-24/h2-3,6-7,18H,1,4-5,8-16H2,(H,22,28)(H,23,27)
InChIKeyUCZAPCYTEDXLBT-UHFFFAOYSA-N
XLogP2.38
TPSA67.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.51
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-Benzylpiperidin-4-yl)-1-phenylurea
CID 4064342
N,N'-(4-Methyl-1,3-phenylene)bis(1-piperidinecarboxamide)
CID 341869
3-{2-[Ethyl(3-methylphenyl)amino]ethyl}-1-(2-methylphenyl)urea
CID 4996665
2H-Benzimidazol-2-one, 1,3-dihydro-1-(phenylmethyl)-4-(1-piperazinyl)-
CID 11587610
1-Cyclohexyl-3-[3-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]urea
CID 25263990
1-Cyclohexyl-3-[2-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]urea
CID 25263991
4-methyl-N-[2-methyl-4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]piperazine-1-carboxamide
CID 25264122
N-(2,5-dimethylphenyl)-N'-[2-(4-propylpiperazin-1-yl)ethyl]urea
CID 22430388
Orphine
CID 21262767
N-(2-methylphenyl)-N'-[3-(4-methylpiperazin-1-yl)propyl]urea
CID 2222200
1-(1-Propionylpiperidin-4-yl)-3-o-tolylurea
CID 49782797
4-benzyl-N-(4-fluorophenyl)piperazine-1-carboxamide
CID 732316

Frequently Asked Questions

What is the IUPAC name of 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide?
The IUPAC name of 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide (CID 136521525) is 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide?
The canonical SMILES for 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide is O=C(NCc1ccccc1N1CCCCC1)N1CCC(N2CCNC2=O)CC1.
What is the InChIKey of 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide?
The InChIKey is UCZAPCYTEDXLBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31N5O2/c27-20(25-13-8-18(9-14-25)26-15-10-22-21(26)28)23-16-17-6-2-3-7-19(17)24-11-4-1-5-12-24/h2-3,6-7,18H,1,4-5,8-16H2,(H,22,28)(H,23,27).
What are the key properties of 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide?
4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide has a molecular weight of 385.51 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxoimidazolidin-1-yl)-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 136521525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).