N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide

C15H29N3O2 — CID 134202421

IUPACN-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide
SMILESCC(=O)N[C@@H](CC(C)(C)C)C(=O)N1C[C@H](C)NC[C@H]1C
InChIInChI=1S/C15H29N3O2/c1-10-9-18(11(2)8-16-10)14(20)13(17-12(3)19)7-15(4,5)6/h10-11,13,16H,7-9H2,1-6H3,(H,17,19)/t10-,11+,13-/m0/s1
InChIKeyLFEDMOZUUWLVSC-LOWVWBTDSA-N
MW283.42 g/mol
LogP1.14
Rot. Bonds3

About N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide

N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide (PubChem CID 134202421) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide.

Molecular Properties

Compound NameN-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide
PubChem CID134202421
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC NameN-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide
SMILESCC(=O)N[C@@H](CC(C)(C)C)C(=O)N1C[C@H](C)NC[C@H]1C
InChIInChI=1S/C15H29N3O2/c1-10-9-18(11(2)8-16-10)14(20)13(17-12(3)19)7-15(4,5)6/h10-11,13,16H,7-9H2,1-6H3,(H,17,19)/t10-,11+,13-/m0/s1
InChIKeyLFEDMOZUUWLVSC-LOWVWBTDSA-N
XLogP1.14
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide 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

Cyclo(glycyl-L-leucyl)
CID 927723
Cyclo(L-leucyl-L-leucyl)
CID 192731
Cyclo(leucylglycine)
CID 2902
Cyclo(alanyl-leucyl)
CID 13879946
2,2-dimethyl-N-[(3S)-2-oxoazepan-3-yl]pentanamide
CID 11218678
(3S,6S)-3,6-Diisopropylpiperazine-2,5-dione
CID 7075896
(3S,6S)-3-(2-Methylpropyl)-6-(propan-2-yl)piperazine-2,5-dione
CID 25220884
3-Isobutyl-6-methyl-2,5-piperazinedione
CID 3634567
3-(2-Butanyl)-6-methyl-2,5-piperazinedione
CID 45359405
(3S,6S)-3-((2S)-butan-2-yl)-6-methylpiperazine-2,5-dione
CID 71359704
(6S)-6-(4-aminobutyl)-1-(2,2-dimethylpropyl)piperazine-2,3-dione
CID 23640882
Ac-leu-nhme
CID 6950977

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide?
The IUPAC name of N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide (CID 134202421) is N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide.
What is the SMILES notation for N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide?
The canonical SMILES for N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide is CC(=O)N[C@@H](CC(C)(C)C)C(=O)N1C[C@H](C)NC[C@H]1C.
What is the InChIKey of N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide?
The InChIKey is LFEDMOZUUWLVSC-LOWVWBTDSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-10-9-18(11(2)8-16-10)14(20)13(17-12(3)19)7-15(4,5)6/h10-11,13,16H,7-9H2,1-6H3,(H,17,19)/t10-,11+,13-/m0/s1.
What are the key properties of N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide?
N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide has a molecular weight of 283.42 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-[(2R,5S)-2,5-dimethylpiperazin-1-yl]-4,4-dimethyl-1-oxopentan-2-yl]acetamide is sourced from PubChem (CID 134202421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).