2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine

C17H34N4 — CID 10756247

IUPAC2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine
SMILESCC(C)(C)CN1CCN(CC(C)(C)C)C(C2=NCCN2)C1
InChIInChI=1S/C17H34N4/c1-16(2,3)12-20-9-10-21(13-17(4,5)6)14(11-20)15-18-7-8-19-15/h14H,7-13H2,1-6H3,(H,18,19)
InChIKeyHNOFEZULXDTTIM-UHFFFAOYSA-N
MW294.49 g/mol
LogP2.07
Rot. Bonds3

About 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine

2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine (PubChem CID 10756247) has the molecular formula C17H34N4 and a molecular weight of 294.49 g/mol. Its IUPAC name is 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine.

Molecular Properties

Compound Name2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine
PubChem CID10756247
Molecular FormulaC17H34N4
Molecular Weight294.49 g/mol
Exact Mass294.28
IUPAC Name2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine
SMILESCC(C)(C)CN1CCN(CC(C)(C)C)C(C2=NCCN2)C1
InChIInChI=1S/C17H34N4/c1-16(2,3)12-20-9-10-21(13-17(4,5)6)14(11-20)15-18-7-8-19-15/h14H,7-13H2,1-6H3,(H,18,19)
InChIKeyHNOFEZULXDTTIM-UHFFFAOYSA-N
XLogP2.07
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.49
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine?
The IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine (CID 10756247) is 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine.
What is the SMILES notation for 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine?
The canonical SMILES for 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine is CC(C)(C)CN1CCN(CC(C)(C)C)C(C2=NCCN2)C1.
What is the InChIKey of 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine?
The InChIKey is HNOFEZULXDTTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N4/c1-16(2,3)12-20-9-10-21(13-17(4,5)6)14(11-20)15-18-7-8-19-15/h14H,7-13H2,1-6H3,(H,18,19).
What are the key properties of 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine?
2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine has a molecular weight of 294.49 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(2,2-dimethylpropyl)piperazine is sourced from PubChem (CID 10756247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).