methoxy(piperazin-1-yl)methanol

C6H14N2O2 — CID 154545795

IUPACmethoxy(piperazin-1-yl)methanol
SMILESCOC(O)N1CCNCC1
InChIInChI=1S/C6H14N2O2/c1-10-6(9)8-4-2-7-3-5-8/h6-7,9H,2-5H2,1H3
InChIKeyDMPQZEAHWOYABT-UHFFFAOYSA-N
MW146.19 g/mol
LogP-1.19
Rot. Bonds2

About methoxy(piperazin-1-yl)methanol

methoxy(piperazin-1-yl)methanol (PubChem CID 154545795) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is methoxy(piperazin-1-yl)methanol.

Molecular Properties

Compound Namemethoxy(piperazin-1-yl)methanol
PubChem CID154545795
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Namemethoxy(piperazin-1-yl)methanol
SMILESCOC(O)N1CCNCC1
InChIInChI=1S/C6H14N2O2/c1-10-6(9)8-4-2-7-3-5-8/h6-7,9H,2-5H2,1H3
InChIKeyDMPQZEAHWOYABT-UHFFFAOYSA-N
XLogP-1.19
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-methoxy-2-piperazin-1-ylbutanamide
CID 69091413
1-(1-methoxypropan-2-yl)piperazine;dihydrochloride
CID 50988385
1-propan-2-ylpiperazine;vanadium
CID 162375922
3-piperazin-1-ylbutane-1,2-diol
CID 163627415
morpholine;1-piperazin-1-ylethanol
CID 67676153
3,3-dimethyl-2-piperazin-1-ylbutan-1-ol
CID 61324971
(2S)-2-methyl-1-piperazin-1-ylpropane-1,3-diol
CID 163688577
1,6-di(piperazin-1-yl)hexane-1,2,5,6-tetrol
CID 70614432
1-piperazin-1-ylprop-2-en-1-ol
CID 66821299
1-(1,4-diazepan-1-yl)propan-1-ol
CID 70607073
1-[(2S)-1-(2-methoxypropan-2-yloxy)propan-2-yl]-1,4,7,10-tetrazacyclododecane
CID 166723382
2-hydroxy-1-piperazin-1-ylpropane-1-sulfonic acid
CID 19008585

Frequently Asked Questions

What is the IUPAC name of methoxy(piperazin-1-yl)methanol?
The IUPAC name of methoxy(piperazin-1-yl)methanol (CID 154545795) is methoxy(piperazin-1-yl)methanol.
What is the SMILES notation for methoxy(piperazin-1-yl)methanol?
The canonical SMILES for methoxy(piperazin-1-yl)methanol is COC(O)N1CCNCC1.
What is the InChIKey of methoxy(piperazin-1-yl)methanol?
The InChIKey is DMPQZEAHWOYABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-10-6(9)8-4-2-7-3-5-8/h6-7,9H,2-5H2,1H3.
What are the key properties of methoxy(piperazin-1-yl)methanol?
methoxy(piperazin-1-yl)methanol has a molecular weight of 146.19 g/mol, XLogP of -1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy(piperazin-1-yl)methanol is sourced from PubChem (CID 154545795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).