6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione

C14H24N2O2 — CID 107888784

IUPAC6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione
SMILESCCCC(C)N1C(=O)C(C)NC(=O)C1(C)C1CC1
InChIInChI=1S/C14H24N2O2/c1-5-6-9(2)16-12(17)10(3)15-13(18)14(16,4)11-7-8-11/h9-11H,5-8H2,1-4H3,(H,15,18)
InChIKeyMHERCSZREAWXAK-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.69
Rot. Bonds4

About 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione

6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione (PubChem CID 107888784) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione
PubChem CID107888784
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione
SMILESCCCC(C)N1C(=O)C(C)NC(=O)C1(C)C1CC1
InChIInChI=1S/C14H24N2O2/c1-5-6-9(2)16-12(17)10(3)15-13(18)14(16,4)11-7-8-11/h9-11H,5-8H2,1-4H3,(H,15,18)
InChIKeyMHERCSZREAWXAK-UHFFFAOYSA-N
XLogP1.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

3-butan-2-yl-6-cyclopropyl-6-methyl-1-pentan-2-ylpiperazine-2,5-dione
CID 107888864
3,6-dicyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione
CID 107888901
6-cyclopropyl-3,6-dimethyl-1-(3-methylbutyl)piperazine-2,5-dione
CID 64874919
1-butan-2-yl-3-tert-butyl-6-cyclopropyl-6-methylpiperazine-2,5-dione
CID 79452305
6-cyclopropyl-3,6-dimethyl-1-(4-methylpentyl)piperazine-2,5-dione
CID 83168999
6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
CID 64900730
1-(2-butoxyethyl)-6-cyclopropyl-3,6-dimethylpiperazine-2,5-dione
CID 64874522
6-cyclopropyl-1-(3-ethylsulfonylpropyl)-3,6-dimethylpiperazine-2,5-dione
CID 65096606
6-cyclopropyl-6-methyl-1-(2-methylpentyl)piperazine-2,5-dione
CID 64879359
6-cyclopropyl-3,6-dimethyl-1-(3-methylbut-2-enyl)piperazine-2,5-dione
CID 107902022
6-cyclopropyl-3,6-dimethyl-1-[(2-methylphenyl)methyl]piperazine-2,5-dione
CID 64874922
1-[(2-chlorophenyl)methyl]-6-cyclopropyl-3,6-dimethylpiperazine-2,5-dione
CID 64874325

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione?
The IUPAC name of 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione (CID 107888784) is 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione is CCCC(C)N1C(=O)C(C)NC(=O)C1(C)C1CC1.
What is the InChIKey of 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione?
The InChIKey is MHERCSZREAWXAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-5-6-9(2)16-12(17)10(3)15-13(18)14(16,4)11-7-8-11/h9-11H,5-8H2,1-4H3,(H,15,18).
What are the key properties of 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione?
6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3,6-dimethyl-1-pentan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 107888784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).