3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione

C11H18N2O2 — CID 64885064

IUPAC3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)C1C(=O)NC(C2CC2)C(=O)N1C
InChIInChI=1S/C11H18N2O2/c1-6(2)9-10(14)12-8(7-4-5-7)11(15)13(9)3/h6-9H,4-5H2,1-3H3,(H,12,14)
InChIKeyLPWUTTIFKGNBEP-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.38
Rot. Bonds2

About 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione

3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione (PubChem CID 64885064) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione
PubChem CID64885064
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione
SMILESCC(C)C1C(=O)NC(C2CC2)C(=O)N1C
InChIInChI=1S/C11H18N2O2/c1-6(2)9-10(14)12-8(7-4-5-7)11(15)13(9)3/h6-9H,4-5H2,1-3H3,(H,12,14)
InChIKeyLPWUTTIFKGNBEP-UHFFFAOYSA-N
XLogP0.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

6-butan-2-yl-3-cyclopropyl-1-methylpiperazine-2,5-dione
CID 64885067
3-cyclopropyl-1-ethyl-6-propan-2-ylpiperazine-2,5-dione
CID 64886195
1-but-3-yn-2-yl-3-cyclopropyl-6-propan-2-ylpiperazine-2,5-dione
CID 114420582
3-cyclopropyl-6-propan-2-yl-1-(2,2,2-trifluoroethyl)piperazine-2,5-dione
CID 64886005
3-cyclopropyl-1-(5-methylhexan-2-yl)-6-propan-2-ylpiperazine-2,5-dione
CID 64971527
3-cyclohexyl-6-propan-2-yl-1-propylpiperazine-2,5-dione
CID 64886211
3-cyclopropyl-6-propan-2-yl-1-[2-(1,3-thiazol-4-yl)ethyl]piperazine-2,5-dione
CID 64971209
6-cyclohexyl-3-cyclopropyl-1-methylpiperazine-2,5-dione
CID 64886585
3-cyclopropyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
CID 64885420
3-cyclopropyl-1-(furan-2-ylmethyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64957667
6-butan-2-yl-1-(cyclopentylmethyl)-3-cyclopropylpiperazine-2,5-dione
CID 64886009
6-tert-butyl-3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione
CID 64886770

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione (CID 64885064) is 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione is CC(C)C1C(=O)NC(C2CC2)C(=O)N1C.
What is the InChIKey of 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione?
The InChIKey is LPWUTTIFKGNBEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-6(2)9-10(14)12-8(7-4-5-7)11(15)13(9)3/h6-9H,4-5H2,1-3H3,(H,12,14).
What are the key properties of 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione?
3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione has a molecular weight of 210.28 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-methyl-6-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64885064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).