1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione

C17H30N2O2 — CID 64973468

IUPAC1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione
SMILESCCC1CCC(N2C(=O)C(C)(C)NC(=O)C2C(C)C)C1C
InChIInChI=1S/C17H30N2O2/c1-7-12-8-9-13(11(12)4)19-14(10(2)3)15(20)18-17(5,6)16(19)21/h10-14H,7-9H2,1-6H3,(H,18,20)
InChIKeyAOYPTLDYWJKFAA-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.57
Rot. Bonds3

About 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione

1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione (PubChem CID 64973468) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione
PubChem CID64973468
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione
SMILESCCC1CCC(N2C(=O)C(C)(C)NC(=O)C2C(C)C)C1C
InChIInChI=1S/C17H30N2O2/c1-7-12-8-9-13(11(12)4)19-14(10(2)3)15(20)18-17(5,6)16(19)21/h10-14H,7-9H2,1-6H3,(H,18,20)
InChIKeyAOYPTLDYWJKFAA-UHFFFAOYSA-N
XLogP2.57
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

1-(3-ethyl-2-methylcyclopentyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64973457
5-butan-2-yl-2-ethyl-3-(3-ethyl-2-methylcyclopentyl)imidazolidin-4-one
CID 83259292
5-butyl-3-(3-ethyl-2-methylcyclopentyl)-2-propan-2-ylimidazolidin-4-one
CID 83266918
1-(2,3-dimethylcyclopentyl)-6-propan-2-yl-3-propylpiperazine-2,5-dione
CID 64973429
1-cyclohexyl-6-ethyl-3,3-dimethylpiperazine-2,5-dione
CID 64958809
3-ethyl-6-propan-2-yl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine-2,5-dione
CID 79351077
1-(3,4-dimethylcyclohexyl)-6-ethyl-3,3-dimethylpiperazine-2,5-dione
CID 64973398
3-butan-2-yl-1-(3-ethyl-2-methylcyclopentyl)piperazine-2,5-dione
CID 64973362
9-(3-ethyl-2-methylcyclopentyl)-7,9-diazaspiro[4.5]decane-6,8,10-trione
CID 115948459
1-(3,5-dimethylcyclohexyl)-6-ethyl-3,3-dimethylpiperazine-2,5-dione
CID 64973557
10-(3-ethyl-2-methylcyclopentyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64973375
3-(3-ethyl-2-methylcyclopentyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83258722

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione (CID 64973468) is 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione is CCC1CCC(N2C(=O)C(C)(C)NC(=O)C2C(C)C)C1C.
What is the InChIKey of 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione?
The InChIKey is AOYPTLDYWJKFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-7-12-8-9-13(11(12)4)19-14(10(2)3)15(20)18-17(5,6)16(19)21/h10-14H,7-9H2,1-6H3,(H,18,20).
What are the key properties of 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione?
1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione has a molecular weight of 294.44 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-2-methylcyclopentyl)-3,3-dimethyl-6-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64973468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).