1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine

C23H26N4 — CID 74226153

IUPAC1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine
SMILESC(=C\c1ccccc1)\CN1CCN(Cc2cnc(-c3ccccc3)[nH]2)CC1
InChIInChI=1S/C23H26N4/c1-3-8-20(9-4-1)10-7-13-26-14-16-27(17-15-26)19-22-18-24-23(25-22)21-11-5-2-6-12-21/h1-12,18H,13-17,19H2,(H,24,25)/b10-7-
InChIKeyYIAWHPIFPMILCC-YFHOEESVSA-N
MW358.49 g/mol
LogP3.91
Rot. Bonds6

About 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine

1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine (PubChem CID 74226153) has the molecular formula C23H26N4 and a molecular weight of 358.49 g/mol. Its IUPAC name is 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine.

Molecular Properties

Compound Name1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine
PubChem CID74226153
Molecular FormulaC23H26N4
Molecular Weight358.49 g/mol
Exact Mass358.22
IUPAC Name1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine
SMILESC(=C\c1ccccc1)\CN1CCN(Cc2cnc(-c3ccccc3)[nH]2)CC1
InChIInChI=1S/C23H26N4/c1-3-8-20(9-4-1)10-7-13-26-14-16-27(17-15-26)19-22-18-24-23(25-22)21-11-5-2-6-12-21/h1-12,18H,13-17,19H2,(H,24,25)/b10-7-
InChIKeyYIAWHPIFPMILCC-YFHOEESVSA-N
XLogP3.91
TPSA35.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazin-1-yl]ethoxy]ethanol
CID 29022137
1-benzhydryl-4-[[2-(4-methylphenyl)-1H-imidazol-5-yl]methyl]piperazine
CID 19106667
1-(2-chloroethyl)-4-(3-phenylprop-2-enyl)piperazine
CID 54353609
1-[(E)-3-phenylprop-2-enyl]azepane
CID 10867670
1-[(2-methylphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine
CID 1377377
1-benzyl-4-(3-phenylprop-2-enyl)piperazine;oxalic acid
CID 171151283
1-[(3-methylphenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine
CID 1376911
1-(naphthalen-2-ylmethyl)-4-[(E)-3-phenylprop-2-enyl]piperazine
CID 1377016
1-[2-(2-chlorophenyl)ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazine
CID 56800369
(3S,4R)-4-phenyl-1-[(2-phenyl-1H-imidazol-5-yl)methyl]pyrrolidin-3-amine;hydrochloride
CID 120770504
2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]acetic acid
CID 43397283
10-[[4-(3-phenylprop-2-enyl)piperazin-1-yl]methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
CID 4965795

Frequently Asked Questions

What is the IUPAC name of 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine?
The IUPAC name of 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine (CID 74226153) is 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine.
What is the SMILES notation for 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine?
The canonical SMILES for 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine is C(=C\c1ccccc1)\CN1CCN(Cc2cnc(-c3ccccc3)[nH]2)CC1.
What is the InChIKey of 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine?
The InChIKey is YIAWHPIFPMILCC-YFHOEESVSA-N. The full InChI is InChI=1S/C23H26N4/c1-3-8-20(9-4-1)10-7-13-26-14-16-27(17-15-26)19-22-18-24-23(25-22)21-11-5-2-6-12-21/h1-12,18H,13-17,19H2,(H,24,25)/b10-7-.
What are the key properties of 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine?
1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine has a molecular weight of 358.49 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine is sourced from PubChem (CID 74226153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).