N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide

C26H32N4O2 — CID 24794311

IUPACN-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide
SMILESCN(Cc1nccn1C)C(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1
InChIInChI=1S/C26H32N4O2/c1-28-19-15-27-25(28)20-29(2)26(31)22-8-10-23(11-9-22)32-24-13-17-30(18-14-24)16-12-21-6-4-3-5-7-21/h3-11,15,19,24H,12-14,16-18,20H2,1-2H3
InChIKeyUIKNSBMLHZQKIO-UHFFFAOYSA-N
MW432.57 g/mol
LogP3.78
Rot. Bonds8

About N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide

N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide (PubChem CID 24794311) has the molecular formula C26H32N4O2 and a molecular weight of 432.57 g/mol. Its IUPAC name is N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide
PubChem CID24794311
Molecular FormulaC26H32N4O2
Molecular Weight432.57 g/mol
Exact Mass432.25
IUPAC NameN-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide
SMILESCN(Cc1nccn1C)C(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1
InChIInChI=1S/C26H32N4O2/c1-28-19-15-27-25(28)20-29(2)26(31)22-8-10-23(11-9-22)32-24-13-17-30(18-14-24)16-12-21-6-4-3-5-7-21/h3-11,15,19,24H,12-14,16-18,20H2,1-2H3
InChIKeyUIKNSBMLHZQKIO-UHFFFAOYSA-N
XLogP3.78
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.57
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-(1H-imidazol-1-yl)ethoxy)benzamide
CID 13569177
N-((Z)-1-(((3-(1H-Imidazol-1-YL)propyl)amino)carbonyl)-2-(4-methoxyphenyl)ethenyl)-4-methylbenzamide
CID 2874948
2-Imidazol-1-ylmethylxanthen-9-one
CID 46867544
(4-Butoxyphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 2094435
N-(3-imidazol-1-ylpropyl)-4-(2,2,2-trifluoroethoxy)benzamide
CID 3807441
4-(hexyloxy)-N-[3-(1H-imidazol-1-yl)propyl]benzamide
CID 4199636
N-[(Z)-2-Furan-2-yl-1-(3-imidazol-1-yl-propylcarbamoyl)-vinyl]-4-methoxy-benzamide
CID 12005525
4-(2-Imidazol-1-yl-ethoxy)-N-methyl-benzamide
CID 13569196
1-[2-(4-Acetylcarbamoylphenoxy)ethyl]imidazole
CID 13569200
1-[2-(4-Benzoylcarbamoylphenoxy)ethyl]imidazole
CID 13569201
(4-(2-(1H-Imidazol-1-yl)ethoxy)phenyl)-(3-(4-bromophenyl)pyrrolidin-1-yl)methanone
CID 44527940
(4-Methoxy-3-(phenylethynyl)phenyl)(4-(pyrazin-2-yl)piperazin-1-yl)methanone
CID 53326424

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide?
The IUPAC name of N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide (CID 24794311) is N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide.
What is the SMILES notation for N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide?
The canonical SMILES for N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide is CN(Cc1nccn1C)C(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1.
What is the InChIKey of N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide?
The InChIKey is UIKNSBMLHZQKIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N4O2/c1-28-19-15-27-25(28)20-29(2)26(31)22-8-10-23(11-9-22)32-24-13-17-30(18-14-24)16-12-21-6-4-3-5-7-21/h3-11,15,19,24H,12-14,16-18,20H2,1-2H3.
What are the key properties of N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide?
N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide has a molecular weight of 432.57 g/mol, XLogP of 3.78, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide is sourced from PubChem (CID 24794311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).