(2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine

C6H14N2O2 — CID 175346878

IUPAC(2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine
SMILESC[C@H]1CN(O)[C@@H](C)CN1O
InChIInChI=1S/C6H14N2O2/c1-5-3-8(10)6(2)4-7(5)9/h5-6,9-10H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKeyKEDZZADHAFJLJF-WDSKDSINSA-N
MW146.19 g/mol
LogP0.16
Rot. Bonds

About (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine

(2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine (PubChem CID 175346878) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine.

Molecular Properties

Compound Name(2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine
PubChem CID175346878
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name(2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine
SMILESC[C@H]1CN(O)[C@@H](C)CN1O
InChIInChI=1S/C6H14N2O2/c1-5-3-8(10)6(2)4-7(5)9/h5-6,9-10H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKeyKEDZZADHAFJLJF-WDSKDSINSA-N
XLogP0.16
TPSA46.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;(2S)-1-hydroxy-2,4-dimethylpiperazine
CID 142979324
(2R)-4-ethyl-1-hydroxy-2-methylpiperazine
CID 89081113
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CID 147795465
(2R,3R,4S)-1-hydroxy-2-methylpyrrolidine-3,4-diol
CID 89313311
(2R)-2-methyl-1-oxidoaziridine
CID 101244990
1-iodo-2-methylaziridine
CID 139722499
(2S)-1-bromo-2-methylaziridine
CID 134926712
(2-methylaziridin-1-yl)phosphinous acid
CID 118349133
2-ethyl-1-hydroxyaziridine
CID 21316390
(2,5-dimethyl-4-silylpiperazin-1-yl)silane
CID 123216940
(2R,5S)-1,4-dichloro-2,5-dimethylpiperazine
CID 129411829
1-hydroxy-3,4-dimethylimidazolidin-2-one
CID 154468014

Frequently Asked Questions

What is the IUPAC name of (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine?
The IUPAC name of (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine (CID 175346878) is (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine.
What is the SMILES notation for (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine?
The canonical SMILES for (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine is C[C@H]1CN(O)[C@@H](C)CN1O.
What is the InChIKey of (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine?
The InChIKey is KEDZZADHAFJLJF-WDSKDSINSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-5-3-8(10)6(2)4-7(5)9/h5-6,9-10H,3-4H2,1-2H3/t5-,6-/m0/s1.
What are the key properties of (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine?
(2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine has a molecular weight of 146.19 g/mol, XLogP of 0.16, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine is sourced from PubChem (CID 175346878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).