1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one

C20H29N3O — CID 69034875

IUPAC1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one
SMILESO=C1N(C2CCCCC2)CC(c2ccccc2)N1C1CCNCC1
InChIInChI=1S/C20H29N3O/c24-20-22(17-9-5-2-6-10-17)15-19(16-7-3-1-4-8-16)23(20)18-11-13-21-14-12-18/h1,3-4,7-8,17-19,21H,2,5-6,9-15H2
InChIKeyKLSIJLOAJVVFKQ-UHFFFAOYSA-N
MW327.47 g/mol
LogP3.55
Rot. Bonds3

About 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one

1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one (PubChem CID 69034875) has the molecular formula C20H29N3O and a molecular weight of 327.47 g/mol. Its IUPAC name is 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one
PubChem CID69034875
Molecular FormulaC20H29N3O
Molecular Weight327.47 g/mol
Exact Mass327.23
IUPAC Name1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one
SMILESO=C1N(C2CCCCC2)CC(c2ccccc2)N1C1CCNCC1
InChIInChI=1S/C20H29N3O/c24-20-22(17-9-5-2-6-10-17)15-19(16-7-3-1-4-8-16)23(20)18-11-13-21-14-12-18/h1,3-4,7-8,17-19,21H,2,5-6,9-15H2
InChIKeyKLSIJLOAJVVFKQ-UHFFFAOYSA-N
XLogP3.55
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.47
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one?
The IUPAC name of 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one (CID 69034875) is 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one.
What is the SMILES notation for 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one?
The canonical SMILES for 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one is O=C1N(C2CCCCC2)CC(c2ccccc2)N1C1CCNCC1.
What is the InChIKey of 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one?
The InChIKey is KLSIJLOAJVVFKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O/c24-20-22(17-9-5-2-6-10-17)15-19(16-7-3-1-4-8-16)23(20)18-11-13-21-14-12-18/h1,3-4,7-8,17-19,21H,2,5-6,9-15H2.
What are the key properties of 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one?
1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one has a molecular weight of 327.47 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-phenyl-3-piperidin-4-ylimidazolidin-2-one is sourced from PubChem (CID 69034875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).