CC1(C)NCCNC1=O
CAS: 22476-74-0
Name: 3,3-dimethylpiperazin-2-one
SMILES: CC1(C)NCCNC1=O

Molecular Processing

Molecular formula
C6H12N2O
Molecular weight
128.18
Exact mass
128.095
XLogP
-0.52
TPSA
41.13
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
35.09

Supplementary Information

InChIKey: ZBFIRYWCOIYJDA-UHFFFAOYSA-N
Synonyme
3,3-dimethylpiperazin-2-one22476-74-03,3-Dimethyl-2-piperazinone2-Piperazinone, 3,3-dimethyl-BRN 0112353Dimethyl-3,3 oxo-2 piperazineDimethyl-3,3 oxo-2 piperazine [French]DTXSID80177002RefChem:478272DTXCID0099493807-425-83,3-Dimethyl-piperazin-2-oneMFCD01701783F2182-0029Piperazinone, 3,3-dimethyl-3,3-dimethylpiperazine-2-one33-Dimethylpiperazin-2-oneSCHEMBL17727SCHEMBL1161491SCHEMBL2543453ZBFIRYWCOIYJDA-UHFFFAOYSA-NHMS1695C04SMSSF-0017641ALBB-007372BBL013287SBB010254STK5044983 pound not3-Dimethylpiperazin-2-oneAKOS000265692AB09796
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