1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione

C14H26N2O3 — CID 65053001

IUPAC1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
SMILESCOCC(C(C)C)N1C(=O)C(C)NC(=O)C1C(C)C
InChIInChI=1S/C14H26N2O3/c1-8(2)11(7-19-6)16-12(9(3)4)13(17)15-10(5)14(16)18/h8-12H,7H2,1-6H3,(H,15,17)
InChIKeyRLZSBPPGHGVLFL-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.03
Rot. Bonds5

About 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione

1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione (PubChem CID 65053001) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
PubChem CID65053001
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
SMILESCOCC(C(C)C)N1C(=O)C(C)NC(=O)C1C(C)C
InChIInChI=1S/C14H26N2O3/c1-8(2)11(7-19-6)16-12(9(3)4)13(17)15-10(5)14(16)18/h8-12H,7H2,1-6H3,(H,15,17)
InChIKeyRLZSBPPGHGVLFL-UHFFFAOYSA-N
XLogP1.03
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 64969249
1-(2-methylpentan-3-yl)-3,6-di(propan-2-yl)piperazine-2,5-dione
CID 64964963
1-(2-methoxypropyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 113383064
1-(1-methoxybutan-2-yl)-3,6-di(propan-2-yl)piperazine-2,5-dione
CID 64972901
3-methyl-1-(2-methylpropyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64872902
3-ethyl-1-(1-methoxy-3-methylbutan-2-yl)-3,6-dimethylpiperazine-2,5-dione
CID 65053725
1-(1-methoxypentan-2-yl)-3,6-dimethylpiperazine-2,5-dione
CID 64972792
1-(1-methoxypentan-2-yl)-6-propan-2-yl-3-propylpiperazine-2,5-dione
CID 64972873
3-methyl-1-[1-(5-methylfuran-2-yl)ethyl]-6-propan-2-ylpiperazine-2,5-dione
CID 64965003
3-ethyl-1-(4-methoxybutan-2-yl)-6-propan-2-ylpiperazine-2,5-dione
CID 64973083
1-(2-fluoroethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 80696895
1-(2-cyclopentyloxyethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 64971200

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione (CID 65053001) is 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione is COCC(C(C)C)N1C(=O)C(C)NC(=O)C1C(C)C.
What is the InChIKey of 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione?
The InChIKey is RLZSBPPGHGVLFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-8(2)11(7-19-6)16-12(9(3)4)13(17)15-10(5)14(16)18/h8-12H,7H2,1-6H3,(H,15,17).
What are the key properties of 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione?
1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione has a molecular weight of 270.37 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 65053001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).