(3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one

C10H20N2O — CID 92975056

IUPAC(3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one
SMILESCC(C)C[C@H]1NC(C)(C)CNC1=O
InChIInChI=1S/C10H20N2O/c1-7(2)5-8-9(13)11-6-10(3,4)12-8/h7-8,12H,5-6H2,1-4H3,(H,11,13)/t8-/m1/s1
InChIKeyHYPCXHOZGZVWOS-MRVPVSSYSA-N
MW184.28 g/mol
LogP0.90
Rot. Bonds2

About (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one

(3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one (PubChem CID 92975056) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one.

Molecular Properties

Compound Name(3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one
PubChem CID92975056
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one
SMILESCC(C)C[C@H]1NC(C)(C)CNC1=O
InChIInChI=1S/C10H20N2O/c1-7(2)5-8-9(13)11-6-10(3,4)12-8/h7-8,12H,5-6H2,1-4H3,(H,11,13)/t8-/m1/s1
InChIKeyHYPCXHOZGZVWOS-MRVPVSSYSA-N
XLogP0.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2-methylpropyl)-1,4-diazaspiro[5.6]dodecan-3-one
CID 96592688
(2R)-2-(2-methylpropyl)-1,4,9-triazaspiro[5.5]undecan-3-one
CID 82391615
(3R,6S)-3,6-bis(2-methylpropyl)piperazine-2,5-dione
CID 23278156
3-cyclopropyl-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione
CID 64883856
(3S,6R)-3-(hydroxymethyl)-6-(2-methylpropyl)piperazine-2,5-dione
CID 162908531
(7S)-7-(2-methylpropyl)-5,8-diazaspiro[3.5]nonane-6,9-dione
CID 11820437
(3S)-3-[(2S)-2-methylbutyl]piperazin-2-one
CID 55253255
4-methylidene-5-(2-methylpropyl)imidazolidin-2-one
CID 89369003
(6S,9S,12S)-7-hydroxy-6-[(1R)-1-hydroxyethyl]-12-[(4-hydroxyphenyl)methyl]-9-(2-methylpropyl)-2,5,8,11,14-pentazaspiro[3.11]pentadecane-10,13-dione
CID 139553896
(3S)-3-(2-methylpropyl)-6-(2-methylpropylidene)piperazine-2,5-dione
CID 131884394
(5R)-3-amino-5-(2-methylpropyl)-2,5-dihydro-1H-pyrazin-6-one
CID 130741711
5-(2-methylpropyl)-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
CID 83258955

Frequently Asked Questions

What is the IUPAC name of (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one?
The IUPAC name of (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one (CID 92975056) is (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one.
What is the SMILES notation for (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one?
The canonical SMILES for (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one is CC(C)C[C@H]1NC(C)(C)CNC1=O.
What is the InChIKey of (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one?
The InChIKey is HYPCXHOZGZVWOS-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-7(2)5-8-9(13)11-6-10(3,4)12-8/h7-8,12H,5-6H2,1-4H3,(H,11,13)/t8-/m1/s1.
What are the key properties of (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one?
(3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one has a molecular weight of 184.28 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5,5-dimethyl-3-(2-methylpropyl)piperazin-2-one is sourced from PubChem (CID 92975056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).