5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one

C13H23N3O2 — CID 107437791

IUPAC5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one
SMILESCC1CC(C)C(C)N(C(=O)C2CNC(=O)CN2)C1
InChIInChI=1S/C13H23N3O2/c1-8-4-9(2)10(3)16(7-8)13(18)11-5-15-12(17)6-14-11/h8-11,14H,4-7H2,1-3H3,(H,15,17)
InChIKeyMWHOSUAYVNOOJD-UHFFFAOYSA-N
MW253.35 g/mol
LogP-0.03
Rot. Bonds1

About 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one

5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one (PubChem CID 107437791) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one.

Molecular Properties

Compound Name5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one
PubChem CID107437791
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one
SMILESCC1CC(C)C(C)N(C(=O)C2CNC(=O)CN2)C1
InChIInChI=1S/C13H23N3O2/c1-8-4-9(2)10(3)16(7-8)13(18)11-5-15-12(17)6-14-11/h8-11,14H,4-7H2,1-3H3,(H,15,17)
InChIKeyMWHOSUAYVNOOJD-UHFFFAOYSA-N
XLogP-0.03
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(4-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)piperazin-2-one
CID 107435155
[(2S)-pyrrolidin-2-yl]-(2,3,5-trimethylpiperidin-1-yl)methanone
CID 104939658
4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone
CID 114593081
5-(azetidine-1-carbonyl)piperazin-2-one
CID 126980518
tert-butyl 5-oxopiperazine-2-carboxylate
CID 103846290
4-methyl-2-(2,3,5-trimethylpiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 114592344
2,2-dimethyl-1-(2,3,5-trimethylpiperidin-1-yl)propan-1-one
CID 114597477
5-(3,6-dihydro-2H-pyridine-1-carbonyl)piperazin-2-one
CID 107437768
methyl 2-[4-(5-oxopiperazine-2-carbonyl)piperazin-1-yl]acetate
CID 107435401
piperidin-4-yl-(2,3,5-trimethylpiperidin-1-yl)methanone
CID 114593112
2-oxo-2-(2,3,5-trimethylpiperidin-1-yl)acetic acid
CID 114594573
5-(4-tert-butylazepane-1-carbonyl)piperazin-2-one
CID 107436688

Frequently Asked Questions

What is the IUPAC name of 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one?
The IUPAC name of 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one (CID 107437791) is 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one.
What is the SMILES notation for 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one?
The canonical SMILES for 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one is CC1CC(C)C(C)N(C(=O)C2CNC(=O)CN2)C1.
What is the InChIKey of 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one?
The InChIKey is MWHOSUAYVNOOJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-8-4-9(2)10(3)16(7-8)13(18)11-5-15-12(17)6-14-11/h8-11,14H,4-7H2,1-3H3,(H,15,17).
What are the key properties of 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one?
5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one has a molecular weight of 253.35 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3,5-trimethylpiperidine-1-carbonyl)piperazin-2-one is sourced from PubChem (CID 107437791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).