1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione

C15H26N2O2 — CID 64887854

IUPAC1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione
SMILESCCCCN1C(=O)C(C)(C2CC2)NC(=O)C1CCC
InChIInChI=1S/C15H26N2O2/c1-4-6-10-17-12(7-5-2)13(18)16-15(3,14(17)19)11-8-9-11/h11-12H,4-10H2,1-3H3,(H,16,18)
InChIKeyBNOJGXRIFBBBKH-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.08
Rot. Bonds6

About 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione

1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione (PubChem CID 64887854) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione
PubChem CID64887854
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione
SMILESCCCCN1C(=O)C(C)(C2CC2)NC(=O)C1CCC
InChIInChI=1S/C15H26N2O2/c1-4-6-10-17-12(7-5-2)13(18)16-15(3,14(17)19)11-8-9-11/h11-12H,4-10H2,1-3H3,(H,16,18)
InChIKeyBNOJGXRIFBBBKH-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopropyl-3-methyl-1,6-dipropylpiperazine-2,5-dione
CID 64886332
3-cyclopropyl-6-ethyl-1-(2-ethylsulfonylethyl)-3-methylpiperazine-2,5-dione
CID 106733614
1-cyclohexyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione
CID 82924808
3-cyclopropyl-1-(2-ethoxyethyl)-6-ethyl-3-methylpiperazine-2,5-dione
CID 64887283
1-butyl-3,6-dicyclopropyl-3,6-dimethylpiperazine-2,5-dione
CID 64885387
1-(cyclobutylmethyl)-3-cyclopropyl-6-ethyl-3-methylpiperazine-2,5-dione
CID 64960315
1-[2-(cyclopenten-1-yl)ethyl]-3-cyclopropyl-6-ethyl-3-methylpiperazine-2,5-dione
CID 106171898
3-cyclopropyl-1-(2-ethylhexyl)-3,6-dimethylpiperazine-2,5-dione
CID 64885751
1-(3-ethoxypropyl)-3,3-diethyl-6-propylpiperazine-2,5-dione
CID 65178420
3-cyclopropyl-1-(3-fluoropropyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 81114687
3,6-dicyclopropyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione
CID 83149405
3,3-diethyl-1,6-dipropylpiperazine-2,5-dione
CID 64886735

Frequently Asked Questions

What is the IUPAC name of 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione?
The IUPAC name of 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione (CID 64887854) is 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione.
What is the SMILES notation for 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione?
The canonical SMILES for 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione is CCCCN1C(=O)C(C)(C2CC2)NC(=O)C1CCC.
What is the InChIKey of 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione?
The InChIKey is BNOJGXRIFBBBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-4-6-10-17-12(7-5-2)13(18)16-15(3,14(17)19)11-8-9-11/h11-12H,4-10H2,1-3H3,(H,16,18).
What are the key properties of 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione?
1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione has a molecular weight of 266.38 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-3-cyclopropyl-3-methyl-6-propylpiperazine-2,5-dione is sourced from PubChem (CID 64887854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).