About (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide
(5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide (PubChem CID 135143677) has the molecular formula C11H21N3O2
and a molecular weight of 227.31 g/mol. Its IUPAC name is (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide.
Molecular Properties
| Compound Name | (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide |
| PubChem CID | 135143677 |
| Molecular Formula | C11H21N3O2 |
| Molecular Weight | 227.31 g/mol |
| Exact Mass | 227.16 |
| IUPAC Name | (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide |
| SMILES | CCCCC1N(C)C(=O)[C@H](C)N1C(=O)NC |
| InChI | InChI=1S/C11H21N3O2/c1-5-6-7-9-13(4)10(15)8(2)14(9)11(16)12-3/h8-9H,5-7H2,1-4H3,(H,12,16)/t8-,9?/m0/s1 |
| InChIKey | WOLZTURTOFTZPL-IENPIDJESA-N |
| XLogP | 1.00 |
| TPSA | 52.65 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.31 |
| LogP ≤ 5 | 1.00 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide?
The IUPAC name of (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide (CID 135143677) is (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide?
The canonical SMILES for (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide is CCCCC1N(C)C(=O)[C@H](C)N1C(=O)NC.
What is the InChIKey of (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide?
The InChIKey is WOLZTURTOFTZPL-IENPIDJESA-N. The full InChI is InChI=1S/C11H21N3O2/c1-5-6-7-9-13(4)10(15)8(2)14(9)11(16)12-3/h8-9H,5-7H2,1-4H3,(H,12,16)/t8-,9?/m0/s1.
What are the key properties of (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide?
(5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide has a molecular weight of 227.31 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-2-butyl-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 135143677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).