(2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone

C18H20N2O2 — CID 43824710

IUPAC(2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
SMILESCN1CCN(C(=O)c2ccccc2O)C(c2ccccc2)C1
InChIInChI=1S/C18H20N2O2/c1-19-11-12-20(16(13-19)14-7-3-2-4-8-14)18(22)15-9-5-6-10-17(15)21/h2-10,16,21H,11-13H2,1H3
InChIKeyUPEFWJNQKDKYMR-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.52
Rot. Bonds2

About (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone

(2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone (PubChem CID 43824710) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
PubChem CID43824710
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name(2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
SMILESCN1CCN(C(=O)c2ccccc2O)C(c2ccccc2)C1
InChIInChI=1S/C18H20N2O2/c1-19-11-12-20(16(13-19)14-7-3-2-4-8-14)18(22)15-9-5-6-10-17(15)21/h2-10,16,21H,11-13H2,1H3
InChIKeyUPEFWJNQKDKYMR-UHFFFAOYSA-N
XLogP2.52
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-bromo-2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 112802623
(4-methyl-2-phenylpiperazin-1-yl)-phenylmethanone
CID 4069484
(2,3-dimethoxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 55452857
(2,6-dichloro-3-pyridinyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 167526074
6-methyl-3-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]-1H-pyridin-2-one
CID 95976202
(4-fluorophenyl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37332392
(4-methyl-2-phenylpiperazin-1-yl)-(5-phenyl-1H-pyrazol-4-yl)methanone
CID 72920798
(4-methyl-2-phenylpiperazin-1-yl)-[2-(2H-tetrazol-5-yl)phenyl]methanone
CID 72863235
(4-methoxyphenyl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37332417
3-[(2R)-4-methyl-2-phenylpiperazine-1-carbonyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridin-2-one
CID 92635252
(4-methyl-2-phenylpiperazin-1-yl)-pyrrolidin-1-ylmethanone
CID 115578734
(4-methyl-2-phenylpiperazin-1-yl)-pyrazin-2-ylmethanone
CID 51251944

Frequently Asked Questions

What is the IUPAC name of (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone?
The IUPAC name of (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone (CID 43824710) is (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone.
What is the SMILES notation for (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone?
The canonical SMILES for (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone is CN1CCN(C(=O)c2ccccc2O)C(c2ccccc2)C1.
What is the InChIKey of (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone?
The InChIKey is UPEFWJNQKDKYMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-19-11-12-20(16(13-19)14-7-3-2-4-8-14)18(22)15-9-5-6-10-17(15)21/h2-10,16,21H,11-13H2,1H3.
What are the key properties of (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone?
(2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone has a molecular weight of 296.37 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxyphenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone is sourced from PubChem (CID 43824710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).