2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

C18H28N2O2 — CID 2946727

IUPAC2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SMILESO=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)N1CCCC1
InChIInChI=1S/C18H28N2O2/c21-16(19-12-17(22)20-3-1-2-4-20)11-18-8-13-5-14(9-18)7-15(6-13)10-18/h13-15H,1-12H2,(H,19,21)
InChIKeyUIRWJZLYUYNFHW-UHFFFAOYSA-N
MW304.43 g/mol
LogP2.33
Rot. Bonds4

About 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide (PubChem CID 2946727) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
PubChem CID2946727
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SMILESO=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)N1CCCC1
InChIInChI=1S/C18H28N2O2/c21-16(19-12-17(22)20-3-1-2-4-20)11-18-8-13-5-14(9-18)7-15(6-13)10-18/h13-15H,1-12H2,(H,19,21)
InChIKeyUIRWJZLYUYNFHW-UHFFFAOYSA-N
XLogP2.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The IUPAC name of 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide (CID 2946727) is 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The canonical SMILES for 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide is O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)N1CCCC1.
What is the InChIKey of 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The InChIKey is UIRWJZLYUYNFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c21-16(19-12-17(22)20-3-1-2-4-20)11-18-8-13-5-14(9-18)7-15(6-13)10-18/h13-15H,1-12H2,(H,19,21).
What are the key properties of 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide has a molecular weight of 304.43 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide is sourced from PubChem (CID 2946727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).