1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine

C16H26N2O — CID 66715226

IUPAC1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine
SMILESC=CCC1(CC=C)CNCC(CC=C)(CC=C)N1O
InChIInChI=1S/C16H26N2O/c1-5-9-15(10-6-2)13-17-14-16(11-7-3,12-8-4)18(15)19/h5-8,17,19H,1-4,9-14H2
InChIKeyUMUUGEHNFHYSJW-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.06
Rot. Bonds8

About 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine

1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine (PubChem CID 66715226) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine.

Molecular Properties

Compound Name1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine
PubChem CID66715226
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine
SMILESC=CCC1(CC=C)CNCC(CC=C)(CC=C)N1O
InChIInChI=1S/C16H26N2O/c1-5-9-15(10-6-2)13-17-14-16(11-7-3,12-8-4)18(15)19/h5-8,17,19H,1-4,9-14H2
InChIKeyUMUUGEHNFHYSJW-UHFFFAOYSA-N
XLogP3.06
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine?
The IUPAC name of 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine (CID 66715226) is 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine.
What is the SMILES notation for 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine?
The canonical SMILES for 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine is C=CCC1(CC=C)CNCC(CC=C)(CC=C)N1O.
What is the InChIKey of 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine?
The InChIKey is UMUUGEHNFHYSJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-9-15(10-6-2)13-17-14-16(11-7-3,12-8-4)18(15)19/h5-8,17,19H,1-4,9-14H2.
What are the key properties of 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine?
1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine has a molecular weight of 262.40 g/mol, XLogP of 3.06, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2,2,6,6-tetrakis(prop-2-enyl)piperazine is sourced from PubChem (CID 66715226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).