N-piperazin-1-yloxyethanimine

C6H13N3O — CID 175552933

IUPACN-piperazin-1-yloxyethanimine
SMILESCC=NON1CCNCC1
InChIInChI=1S/C6H13N3O/c1-2-8-10-9-5-3-7-4-6-9/h2,7H,3-6H2,1H3
InChIKeyIWOHELNEDRHHNB-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.17
Rot. Bonds2

About N-piperazin-1-yloxyethanimine

N-piperazin-1-yloxyethanimine (PubChem CID 175552933) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is N-piperazin-1-yloxyethanimine.

Molecular Properties

Compound NameN-piperazin-1-yloxyethanimine
PubChem CID175552933
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC NameN-piperazin-1-yloxyethanimine
SMILESCC=NON1CCNCC1
InChIInChI=1S/C6H13N3O/c1-2-8-10-9-5-3-7-4-6-9/h2,7H,3-6H2,1H3
InChIKeyIWOHELNEDRHHNB-UHFFFAOYSA-N
XLogP-0.17
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methane;1-methoxypiperazine
CID 142233800
ethane;1-methoxypiperazine
CID 142806936
methane;1-methoxypiperazine
CID 157354149
1-piperazin-1-yloxypiperazine;dihydrochloride
CID 174358981
piperazin-1-yl acetate
CID 54492305
dipiperazin-1-yl oxalate
CID 57296724
3-piperazin-1-yloxybutan-2-ol
CID 22485419
1-[(2-methylpropan-2-yl)oxy]-1,4-diazepane
CID 68593726
dimethyl piperazin-1-yl phosphate
CID 175316029
piperazin-1-yl propanoate
CID 12863406
1-[(3Z,5E)-5-methoxyhepta-1,3,5-trien-2-yl]piperazine
CID 142202942
ethane;1-methylpiperazine
CID 91350928

Frequently Asked Questions

What is the IUPAC name of N-piperazin-1-yloxyethanimine?
The IUPAC name of N-piperazin-1-yloxyethanimine (CID 175552933) is N-piperazin-1-yloxyethanimine.
What is the SMILES notation for N-piperazin-1-yloxyethanimine?
The canonical SMILES for N-piperazin-1-yloxyethanimine is CC=NON1CCNCC1.
What is the InChIKey of N-piperazin-1-yloxyethanimine?
The InChIKey is IWOHELNEDRHHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-2-8-10-9-5-3-7-4-6-9/h2,7H,3-6H2,1H3.
What are the key properties of N-piperazin-1-yloxyethanimine?
N-piperazin-1-yloxyethanimine has a molecular weight of 143.19 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperazin-1-yloxyethanimine is sourced from PubChem (CID 175552933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).