4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide

C47H55BrN8O5 — CID 159634373

IUPAC4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide
SMILESBr.COc1ccc(N2CCC(N(C)C(=O)n3cnc(-c4ccc(C)cc4)c3)CC2)cc1.COc1ccc(N2CCC(N(C)C(=O)n3cnc(-c4ccc(O)cc4)c3)CC2)cc1
InChIInChI=1S/C24H28N4O2.C23H26N4O3.BrH/c1-18-4-6-19(7-5-18)23-16-28(17-25-23)24(29)26(2)20-12-14-27(15-13-20)21-8-10-22(30-3)11-9-21;1-25(18-11-13-26(14-12-18)19-5-9-21(30-2)10-6-19)23(29)27-15-22(24-16-27)17-3-7-20(28)8-4-17;/h4-11,16-17,20H,12-15H2,1-3H3;3-10,15-16,18,28H,11-14H2,1-2H3;1H
InChIKeyPDWHVVACJPCNBZ-UHFFFAOYSA-N
MW891.91 g/mol
LogP8.85
Rot. Bonds8

About 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide

4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide (PubChem CID 159634373) has the molecular formula C47H55BrN8O5 and a molecular weight of 891.91 g/mol. Its IUPAC name is 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide.

Molecular Properties

Compound Name4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide
PubChem CID159634373
Molecular FormulaC47H55BrN8O5
Molecular Weight891.91 g/mol
Exact Mass890.35
IUPAC Name4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide
SMILESBr.COc1ccc(N2CCC(N(C)C(=O)n3cnc(-c4ccc(C)cc4)c3)CC2)cc1.COc1ccc(N2CCC(N(C)C(=O)n3cnc(-c4ccc(O)cc4)c3)CC2)cc1
InChIInChI=1S/C24H28N4O2.C23H26N4O3.BrH/c1-18-4-6-19(7-5-18)23-16-28(17-25-23)24(29)26(2)20-12-14-27(15-13-20)21-8-10-22(30-3)11-9-21;1-25(18-11-13-26(14-12-18)19-5-9-21(30-2)10-6-19)23(29)27-15-22(24-16-27)17-3-7-20(28)8-4-17;/h4-11,16-17,20H,12-15H2,1-3H3;3-10,15-16,18,28H,11-14H2,1-2H3;1H
InChIKeyPDWHVVACJPCNBZ-UHFFFAOYSA-N
XLogP8.85
TPSA121.43 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds8
Heavy Atoms61
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500891.91
LogP ≤ 58.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-acetylpiperidin-4-yl)-4-(4-hydroxyphenyl)-N-methylimidazole-1-carboxamide
CID 66682485
N-cyclohexyl-N-methyl-4-(3-methylphenyl)imidazole-1-carboxamide
CID 66714003
4-(1-methoxypyridin-1-ium-3-yl)-N-methyl-N-(oxan-4-yl)imidazole-1-carboxamide
CID 70224645
N-cyclohexyl-4-(3-fluoro-4-hydroxyphenyl)-N-methylimidazole-1-carboxamide
CID 66683058
(Z)-but-2-enedioic acid;[4-[1-[[1-[(3,5-dimethoxyphenyl)methyl]piperidin-4-yl]-methylcarbamoyl]imidazol-4-yl]phenyl] sulfamate
CID 121393605
4-[3-[amino(hydroxy)methyl]phenyl]-N-[1-(2-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide
CID 123707604
[4-(4-methoxyphenyl)piperazin-1-yl]-[3-(4-methylphenyl)-1H-pyrazol-5-yl]methanone
CID 51046465
N-cyclopentyl-N-methyl-4-[3-(methylamino)phenyl]imidazole-1-carboxamide
CID 123757708
4-(4-methylphenyl)imidazole-1-carboxylic acid
CID 174417418
N-hydroxy-4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]-N-propan-2-ylpiperidine-1-carboxamide
CID 59486572
(4-methylphenyl) 1-(4-methylphenyl)piperidine-4-carboxylate
CID 139337231
1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide
CID 67218664

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide?
The IUPAC name of 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide (CID 159634373) is 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide.
What is the SMILES notation for 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide?
The canonical SMILES for 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide is Br.COc1ccc(N2CCC(N(C)C(=O)n3cnc(-c4ccc(C)cc4)c3)CC2)cc1.COc1ccc(N2CCC(N(C)C(=O)n3cnc(-c4ccc(O)cc4)c3)CC2)cc1.
What is the InChIKey of 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide?
The InChIKey is PDWHVVACJPCNBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O2.C23H26N4O3.BrH/c1-18-4-6-19(7-5-18)23-16-28(17-25-23)24(29)26(2)20-12-14-27(15-13-20)21-8-10-22(30-3)11-9-21;1-25(18-11-13-26(14-12-18)19-5-9-21(30-2)10-6-19)23(29)27-15-22(24-16-27)17-3-7-20(28)8-4-17;/h4-11,16-17,20H,12-15H2,1-3H3;3-10,15-16,18,28H,11-14H2,1-2H3;1H.
What are the key properties of 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide?
4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide has a molecular weight of 891.91 g/mol, XLogP of 8.85, 8 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxyphenyl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methylimidazole-1-carboxamide;N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-methyl-4-(4-methylphenyl)imidazole-1-carboxamide;hydrobromide is sourced from PubChem (CID 159634373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).