1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine

C19H20ClN5 — CID 18671631

IUPAC1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine
SMILESCN1CCN(c2ccc(-c3ncc(-c4cccc(Cl)c4)[nH]3)cn2)CC1
InChIInChI=1S/C19H20ClN5/c1-24-7-9-25(10-8-24)18-6-5-15(12-21-18)19-22-13-17(23-19)14-3-2-4-16(20)11-14/h2-6,11-13H,7-10H2,1H3,(H,22,23)
InChIKeyDQLQJNJBLLPDFQ-UHFFFAOYSA-N
MW353.86 g/mol
LogP3.54
Rot. Bonds3

About 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine

1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine (PubChem CID 18671631) has the molecular formula C19H20ClN5 and a molecular weight of 353.86 g/mol. Its IUPAC name is 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine.

Molecular Properties

Compound Name1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine
PubChem CID18671631
Molecular FormulaC19H20ClN5
Molecular Weight353.86 g/mol
Exact Mass353.14
IUPAC Name1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine
SMILESCN1CCN(c2ccc(-c3ncc(-c4cccc(Cl)c4)[nH]3)cn2)CC1
InChIInChI=1S/C19H20ClN5/c1-24-7-9-25(10-8-24)18-6-5-15(12-21-18)19-22-13-17(23-19)14-3-2-4-16(20)11-14/h2-6,11-13H,7-10H2,1H3,(H,22,23)
InChIKeyDQLQJNJBLLPDFQ-UHFFFAOYSA-N
XLogP3.54
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.86
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(5-phenyl-1H-imidazol-2-yl)-2-pyridinyl]piperazine
CID 18671610
2-bromo-5-[2-(3-chlorophenyl)-1H-imidazol-5-yl]pyridine
CID 90370615
1-methyl-4-[5-(1H-pyrrol-2-yl)-2-pyridinyl]piperazine
CID 141163606
1-(cyclopropylmethyl)-4-[5-[5-(3,4-dimethoxyphenyl)-1H-imidazol-2-yl]-2-pyridinyl]piperazine
CID 18671555
2-chloro-5-(3-chlorophenyl)-1H-imidazole
CID 105466466
6-chloro-2-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-pyridin-2-yl-1H-benzimidazole
CID 72707006
3-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-4-methylmorpholine
CID 78151272
1-[(3-chlorophenyl)methyl]-2-methyl-3-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]guanidine;hydroiodide
CID 111177135
6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one
CID 177382697
2-[5-(3-chlorophenyl)-2-pyridinyl]-1,5,5-trimethylpyrazolidin-3-one
CID 70936653
1-(3-chlorophenyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]cyclopropane-1-carboxamide
CID 37049250
4-(3-fluorophenyl)-2-[4-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1H-pyrazol-5-yl]-1H-benzimidazole
CID 154654111

Frequently Asked Questions

What is the IUPAC name of 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine?
The IUPAC name of 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine (CID 18671631) is 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine.
What is the SMILES notation for 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine?
The canonical SMILES for 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine is CN1CCN(c2ccc(-c3ncc(-c4cccc(Cl)c4)[nH]3)cn2)CC1.
What is the InChIKey of 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine?
The InChIKey is DQLQJNJBLLPDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN5/c1-24-7-9-25(10-8-24)18-6-5-15(12-21-18)19-22-13-17(23-19)14-3-2-4-16(20)11-14/h2-6,11-13H,7-10H2,1H3,(H,22,23).
What are the key properties of 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine?
1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine has a molecular weight of 353.86 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-4-methylpiperazine is sourced from PubChem (CID 18671631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).