6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione

C14H24N2O2 — CID 107888826

IUPAC6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione
SMILESCCCC(C)N1C(=O)C(CC)NC(=O)C1C1CC1
InChIInChI=1S/C14H24N2O2/c1-4-6-9(3)16-12(10-7-8-10)13(17)15-11(5-2)14(16)18/h9-12H,4-8H2,1-3H3,(H,15,17)
InChIKeyUZECYNUTCOZASJ-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.69
Rot. Bonds5

About 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione

6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione (PubChem CID 107888826) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione
PubChem CID107888826
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione
SMILESCCCC(C)N1C(=O)C(CC)NC(=O)C1C1CC1
InChIInChI=1S/C14H24N2O2/c1-4-6-9(3)16-12(10-7-8-10)13(17)15-11(5-2)14(16)18/h9-12H,4-8H2,1-3H3,(H,15,17)
InChIKeyUZECYNUTCOZASJ-UHFFFAOYSA-N
XLogP1.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-cyclopropyl-3-ethyl-1-propylpiperazine-2,5-dione
CID 64901468
3-cyclopropyl-6-ethyl-1-pentan-2-ylpiperazine-2,5-dione
CID 64957333
6-cyclopropyl-3-ethyl-1-methylpiperazine-2,5-dione
CID 64903767
3-ethyl-1-pentan-2-yl-6-phenylpiperazine-2,5-dione
CID 64957262
6-cyclopropyl-3-ethyl-1-hexylpiperazine-2,5-dione
CID 64902231
1,3-di(butan-2-yl)-6-cyclopropylpiperazine-2,5-dione
CID 79452090
1-pentan-2-yl-6-propan-2-yl-3-propylpiperazine-2,5-dione
CID 64957236
3-ethyl-1-hexan-3-yl-6-propan-2-ylpiperazine-2,5-dione
CID 64969006
6-cyclopropyl-3-ethyl-1-(2-methoxyethyl)piperazine-2,5-dione
CID 64901847
3-cyclopropyl-7-methyl-1-pentan-2-yl-1,4-diazepane-2,5-dione
CID 114013090
3-ethyl-1-(4-methoxybutan-2-yl)-6-propan-2-ylpiperazine-2,5-dione
CID 64973083
6-cyclopropyl-3-ethyl-1-(3-methylsulfonylpropyl)piperazine-2,5-dione
CID 64903765

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione?
The IUPAC name of 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione (CID 107888826) is 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione is CCCC(C)N1C(=O)C(CC)NC(=O)C1C1CC1.
What is the InChIKey of 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione?
The InChIKey is UZECYNUTCOZASJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-4-6-9(3)16-12(10-7-8-10)13(17)15-11(5-2)14(16)18/h9-12H,4-8H2,1-3H3,(H,15,17).
What are the key properties of 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione?
6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-ethyl-1-pentan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 107888826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).