1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one

C20H30N2O2 — CID 68905904

IUPAC1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one
SMILESCC1(C2CC2)C(C2C3CC4CC2CC(O)(C4)C3)NC(=O)N1C1CC1
InChIInChI=1S/C20H30N2O2/c1-19(14-2-3-14)17(21-18(23)22(19)15-4-5-15)16-12-6-11-7-13(16)10-20(24,8-11)9-12/h11-17,24H,2-10H2,1H3,(H,21,23)
InChIKeyAZTXGASTBWRMMW-UHFFFAOYSA-N
MW330.47 g/mol
LogP2.90
Rot. Bonds3

About 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one

1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one (PubChem CID 68905904) has the molecular formula C20H30N2O2 and a molecular weight of 330.47 g/mol. Its IUPAC name is 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one.

Molecular Properties

Compound Name1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one
PubChem CID68905904
Molecular FormulaC20H30N2O2
Molecular Weight330.47 g/mol
Exact Mass330.23
IUPAC Name1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one
SMILESCC1(C2CC2)C(C2C3CC4CC2CC(O)(C4)C3)NC(=O)N1C1CC1
InChIInChI=1S/C20H30N2O2/c1-19(14-2-3-14)17(21-18(23)22(19)15-4-5-15)16-12-6-11-7-13(16)10-20(24,8-11)9-12/h11-17,24H,2-10H2,1H3,(H,21,23)
InChIKeyAZTXGASTBWRMMW-UHFFFAOYSA-N
XLogP2.90
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one?
The IUPAC name of 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one (CID 68905904) is 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one.
What is the SMILES notation for 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one?
The canonical SMILES for 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one is CC1(C2CC2)C(C2C3CC4CC2CC(O)(C4)C3)NC(=O)N1C1CC1.
What is the InChIKey of 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one?
The InChIKey is AZTXGASTBWRMMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O2/c1-19(14-2-3-14)17(21-18(23)22(19)15-4-5-15)16-12-6-11-7-13(16)10-20(24,8-11)9-12/h11-17,24H,2-10H2,1H3,(H,21,23).
What are the key properties of 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one?
1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one has a molecular weight of 330.47 g/mol, XLogP of 2.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dicyclopropyl-4-(5-hydroxy-2-adamantyl)-5-methylimidazolidin-2-one is sourced from PubChem (CID 68905904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).