4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one

C19H33N3O2 — CID 112826695

IUPAC4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one
SMILESCCC(CC)N1CC(C(=O)N2CCN(C3CCCC3)CC2)CC1=O
InChIInChI=1S/C19H33N3O2/c1-3-16(4-2)22-14-15(13-18(22)23)19(24)21-11-9-20(10-12-21)17-7-5-6-8-17/h15-17H,3-14H2,1-2H3
InChIKeyMOKZTUMNNNZLGQ-UHFFFAOYSA-N
MW335.49 g/mol
LogP2.11
Rot. Bonds5

About 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one

4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one (PubChem CID 112826695) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one.

Molecular Properties

Compound Name4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one
PubChem CID112826695
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC Name4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one
SMILESCCC(CC)N1CC(C(=O)N2CCN(C3CCCC3)CC2)CC1=O
InChIInChI=1S/C19H33N3O2/c1-3-16(4-2)22-14-15(13-18(22)23)19(24)21-11-9-20(10-12-21)17-7-5-6-8-17/h15-17H,3-14H2,1-2H3
InChIKeyMOKZTUMNNNZLGQ-UHFFFAOYSA-N
XLogP2.11
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-oxo-1-pentan-3-ylpyrrolidine-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 119355319
1-pentan-3-yl-4-(4-phenylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 112826915
4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]-1-pentan-3-ylpyrrolidin-2-one
CID 112826883
4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]-1-pentan-3-ylpyrrolidin-2-one
CID 119649660
[4-(4-cyclopentylpiperazine-1-carbonyl)cyclohexyl]-(4-cyclopentylpiperazin-1-yl)methanone
CID 112815528
1-[(2S)-1-hydroxybutan-2-yl]-5-oxopyrrolidine-3-carboxylic acid
CID 168690219
4-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carbonyl]-1-pentan-3-ylpyrrolidin-2-one
CID 112826872
4-(4-cyclopentylpiperazine-1-carbonyl)-1-(4-methylsulfanylphenyl)pyrrolidin-2-one
CID 55584434
4-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazine-1-carbonyl]-1-pentan-3-ylpyrrolidin-2-one
CID 112827875
(4S)-1-cyclopentyl-4-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 9364634
(4R)-1-cyclopentyl-4-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 9364632
1-cyclohexyl-4-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 4251317

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one?
The IUPAC name of 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one (CID 112826695) is 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one.
What is the SMILES notation for 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one?
The canonical SMILES for 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one is CCC(CC)N1CC(C(=O)N2CCN(C3CCCC3)CC2)CC1=O.
What is the InChIKey of 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one?
The InChIKey is MOKZTUMNNNZLGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O2/c1-3-16(4-2)22-14-15(13-18(22)23)19(24)21-11-9-20(10-12-21)17-7-5-6-8-17/h15-17H,3-14H2,1-2H3.
What are the key properties of 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one?
4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one has a molecular weight of 335.49 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopentylpiperazine-1-carbonyl)-1-pentan-3-ylpyrrolidin-2-one is sourced from PubChem (CID 112826695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).