3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione

C14H22N2O2 — CID 64971281

IUPAC3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione
SMILESCC1(CN2CC(=O)NC(C3CC3)C2=O)CCCC1
InChIInChI=1S/C14H22N2O2/c1-14(6-2-3-7-14)9-16-8-11(17)15-12(13(16)18)10-4-5-10/h10,12H,2-9H2,1H3,(H,15,17)
InChIKeySBAFCTHZAQGRCP-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.30
Rot. Bonds3

About 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione

3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione (PubChem CID 64971281) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione.

Molecular Properties

Compound Name3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione
PubChem CID64971281
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione
SMILESCC1(CN2CC(=O)NC(C3CC3)C2=O)CCCC1
InChIInChI=1S/C14H22N2O2/c1-14(6-2-3-7-14)9-16-8-11(17)15-12(13(16)18)10-4-5-10/h10,12H,2-9H2,1H3,(H,15,17)
InChIKeySBAFCTHZAQGRCP-UHFFFAOYSA-N
XLogP1.30
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]-1,4-diazepane-2,5-dione
CID 64971130
1-[(1-methylcyclopentyl)methyl]-3-propylpiperazine-2,5-dione
CID 64971362
3-cyclopropyl-1-propylpiperazine-2,5-dione
CID 64879619
3-cyclopropyl-1-(2-methylpropyl)piperazine-2,5-dione
CID 64881556
3-cyclopropyl-1-(2-methyl-2-methylsulfanylpropyl)piperazine-2,5-dione
CID 113479458
3-cyclopropyl-1-(oxolan-2-ylmethyl)piperazine-2,5-dione
CID 64879241
3-cyclopropyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione
CID 79350646
1-[(E)-3-chloroprop-2-enyl]-3-cyclopropylpiperazine-2,5-dione
CID 107902448
3-cyclopropyl-1-propan-2-ylpiperazine-2,5-dione
CID 64879421
3-cyclopropyl-1-[(2-ethylphenyl)methyl]piperazine-2,5-dione
CID 64973621
3-cyclopropyl-1-[2-(4-fluorophenyl)ethyl]piperazine-2,5-dione
CID 64957044
3-cyclohexyl-1-prop-2-ynylpiperazine-2,5-dione
CID 64963666

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione?
The IUPAC name of 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione (CID 64971281) is 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione.
What is the SMILES notation for 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione?
The canonical SMILES for 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione is CC1(CN2CC(=O)NC(C3CC3)C2=O)CCCC1.
What is the InChIKey of 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione?
The InChIKey is SBAFCTHZAQGRCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-14(6-2-3-7-14)9-16-8-11(17)15-12(13(16)18)10-4-5-10/h10,12H,2-9H2,1H3,(H,15,17).
What are the key properties of 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione?
3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione has a molecular weight of 250.34 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-[(1-methylcyclopentyl)methyl]piperazine-2,5-dione is sourced from PubChem (CID 64971281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).