[4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone

C15H18N4O2 — CID 146122602

IUPAC[4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone
SMILESCc1ncc(C(=O)N2CCN(c3cccc(O)c3)CC2)[nH]1
InChIInChI=1S/C15H18N4O2/c1-11-16-10-14(17-11)15(21)19-7-5-18(6-8-19)12-3-2-4-13(20)9-12/h2-4,9-10,20H,5-8H2,1H3,(H,16,17)
InChIKeyNHDPLZCGBKBEJU-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.39
Rot. Bonds2

About [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone

[4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone (PubChem CID 146122602) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone.

Molecular Properties

Compound Name[4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone
PubChem CID146122602
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name[4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone
SMILESCc1ncc(C(=O)N2CCN(c3cccc(O)c3)CC2)[nH]1
InChIInChI=1S/C15H18N4O2/c1-11-16-10-14(17-11)15(21)19-7-5-18(6-8-19)12-3-2-4-13(20)9-12/h2-4,9-10,20H,5-8H2,1H3,(H,16,17)
InChIKeyNHDPLZCGBKBEJU-UHFFFAOYSA-N
XLogP1.39
TPSA72.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone
CID 154738408
[(3R)-4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone
CID 97238184
[(3S)-4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone
CID 97238185
(3-hydroxyphenyl)-[4-(2-methyl-4-pyridinyl)piperazin-1-yl]methanone
CID 133464338
[4-(3-hydroxyphenyl)piperazin-1-yl]-(1H-indazol-4-yl)methanone
CID 166229211
(1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(3-hydroxyphenyl)piperazin-1-yl]methanone
CID 112799070
[4-(3-hydroxyphenyl)piperazin-1-yl]-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methanone
CID 112810065
7-[4-(3-hydroxyphenyl)piperazine-1-carbonyl]-2H-phthalazin-1-one
CID 167829626
[4-(3-chlorophenyl)piperazin-1-yl]-(2-methylpyrimidin-5-yl)methanone
CID 96588883
[4-[(1S)-1-(2-fluorophenyl)ethyl]piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone
CID 95768224
[4-(3-hydroxyphenyl)piperazin-1-yl]-[5-methyl-1-(3-nitrophenyl)triazol-4-yl]methanone
CID 112809128
(2-methylpyrimidin-5-yl)-(4-phenylpiperazin-1-yl)methanone
CID 96588033

Frequently Asked Questions

What is the IUPAC name of [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone?
The IUPAC name of [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone (CID 146122602) is [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone.
What is the SMILES notation for [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone?
The canonical SMILES for [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone is Cc1ncc(C(=O)N2CCN(c3cccc(O)c3)CC2)[nH]1.
What is the InChIKey of [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone?
The InChIKey is NHDPLZCGBKBEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-11-16-10-14(17-11)15(21)19-7-5-18(6-8-19)12-3-2-4-13(20)9-12/h2-4,9-10,20H,5-8H2,1H3,(H,16,17).
What are the key properties of [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone?
[4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone has a molecular weight of 286.34 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-hydroxyphenyl)piperazin-1-yl]-(2-methyl-1H-imidazol-5-yl)methanone is sourced from PubChem (CID 146122602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).