2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide

C70H67N9O7 — CID 158423604

IUPAC2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nc(-c3ccccc3)c(C)[nH]2)cc1.Cc1[nH]c(-c2ccc(CO)c(O)c2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2CO)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2O)nc1-c1ccccc1
InChIInChI=1S/C18H17N3O.C18H18N2O2.2C17H16N2O2/c1-12-17(14-6-4-3-5-7-14)21-18(19-12)15-8-10-16(11-9-15)20-13(2)22;1-12-17(14-5-3-2-4-6-14)20-18(19-12)16-8-7-13(10-21)9-15(16)11-22;1-11-16(13-5-3-2-4-6-13)19-17(18-11)14-8-7-12(10-20)9-15(14)21;1-11-16(12-5-3-2-4-6-12)19-17(18-11)13-7-8-14(10-20)15(21)9-13/h3-11H,1-2H3,(H,19,21)(H,20,22);2-9,21-22H,10-11H2,1H3,(H,19,20);2*2-9,20-21H,10H2,1H3,(H,18,19)
InChIKeyHATYTBSIIRGDEX-UHFFFAOYSA-N
MW1146.36 g/mol
LogP13.55
Rot. Bonds13

About 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide

2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide (PubChem CID 158423604) has the molecular formula C70H67N9O7 and a molecular weight of 1146.36 g/mol. Its IUPAC name is 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide
PubChem CID158423604
Molecular FormulaC70H67N9O7
Molecular Weight1146.36 g/mol
Exact Mass1145.52
IUPAC Name2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nc(-c3ccccc3)c(C)[nH]2)cc1.Cc1[nH]c(-c2ccc(CO)c(O)c2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2CO)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2O)nc1-c1ccccc1
InChIInChI=1S/C18H17N3O.C18H18N2O2.2C17H16N2O2/c1-12-17(14-6-4-3-5-7-14)21-18(19-12)15-8-10-16(11-9-15)20-13(2)22;1-12-17(14-5-3-2-4-6-14)20-18(19-12)16-8-7-13(10-21)9-15(16)11-22;1-11-16(13-5-3-2-4-6-13)19-17(18-11)14-8-7-12(10-20)9-15(14)21;1-11-16(12-5-3-2-4-6-12)19-17(18-11)13-7-8-14(10-20)15(21)9-13/h3-11H,1-2H3,(H,19,21)(H,20,22);2-9,21-22H,10-11H2,1H3,(H,19,20);2*2-9,20-21H,10H2,1H3,(H,18,19)
InChIKeyHATYTBSIIRGDEX-UHFFFAOYSA-N
XLogP13.55
TPSA265.20 Ų
H-Bond Donors11
H-Bond Acceptors11
Rotatable Bonds13
Heavy Atoms86
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001146.36
LogP ≤ 513.55
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1011

Analyze 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide with MolForge

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Related Compounds

2-(3-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;2-(4-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;4-[3-(1,1-difluoroethyl)phenyl]-5-methyl-2-phenyl-1H-imidazole;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole
CID 158101445
2-(3-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;2-(4-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;4-[3-(1,1-difluoroethyl)phenyl]-5-methyl-2-phenyl-1H-imidazole;2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide;[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole
CID 161627531
2-(3-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;2-(4-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;4-[3-(1,1-difluoroethyl)phenyl]-5-methyl-2-phenyl-1H-imidazole;2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[3-hydroxy-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide;[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole
CID 161656842
2-(3-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;2-(4-chlorophenyl)-5-methyl-4-phenyl-1H-imidazole;4-[3-(1,1-difluoroethyl)phenyl]-5-methyl-2-phenyl-1H-imidazole;2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;2-hydroxy-N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide;[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole
CID 163925082
2-[4,5-bis[4-(diethylamino)phenyl]-1-phenylimidazol-2-yl]-4,6-dimethylphenol;6-[4,5-bis[4-(dimethylamino)phenyl]-1H-imidazol-2-yl]-2,3,4-trimethylphenol
CID 137125078
2,6-bis(1H-benzimidazol-2-yl)-4-[3,5-bis(1H-benzimidazol-2-yl)-4-hydroxyphenyl]phenol
CID 139797671
2-[3-[2,5-Dihydroxy-4-(2-propan-2-yl-1,5-dihydroimidazo[4,5-f]benzimidazol-6-yl)phenyl]-5-[2,5-dihydroxy-4-(6-propan-2-yl-3,7-dihydropyrrolo[3,2-f]benzimidazol-2-yl)phenyl]-2,4,6-tri(propan-2-yl)phenyl]-5-(2-propan-2-yl-1,5-dihydroimidazo[4,5-f]benzimidazol-6-yl)benzene-1,4-diol
CID 149587505
2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide
CID 157610324
4-[4,5-bis[4-(diethylamino)phenyl]-1-phenylimidazol-2-yl]-2,6-dimethylphenol;1-[4,5-bis[4-(dimethylamino)phenyl]-2-(4-hydroxy-3,5-dimethylphenyl)imidazol-1-yl]ethanone;4-[4,5-bis[4-(dimethylamino)phenyl]-1H-imidazol-2-yl]-2,6-dimethylphenol;4-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2,6-dimethylphenol
CID 158018191
2,6-dicyclohexyl-4-[4-[4-(dimethylamino)phenyl]-5-(2-phenylethyl)-1H-imidazol-2-yl]phenol;4-[5-[4-(diethylamino)phenyl]-1-ethyl-4-(2-phenylethyl)imidazol-2-yl]-2,6-dimethylphenol;4-[5-[4-(diethylamino)phenyl]-1-phenyl-4-(2-phenylethyl)imidazol-2-yl]-2,6-dimethylphenol;4-[4-[4-(dimethylamino)phenyl]-5-(2-phenylethyl)-1H-imidazol-2-yl]-2,6-dimethylphenol
CID 159639695
3-(5-iodo-1H-phenanthro[9,10-d]imidazol-2-yl)phenol;2-(3-iodophenyl)-1H-phenanthro[9,10-d]imidazole;2-(2-methylphenyl)-1H-phenanthro[9,10-d]imidazole;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-quinolin-2-one
CID 159656462
4-[4,5-bis[4-(diethylamino)phenyl]-1-phenylimidazol-2-yl]-2,6-dimethylphenol;1-[4,5-bis[4-(dimethylamino)phenyl]-2-(4-hydroxy-3,5-dimethylphenyl)imidazol-1-yl]ethanone;4-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2,6-dimethylphenol
CID 161415616

Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide?
The IUPAC name of 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide (CID 158423604) is 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide?
The canonical SMILES for 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2nc(-c3ccccc3)c(C)[nH]2)cc1.Cc1[nH]c(-c2ccc(CO)c(O)c2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2CO)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(CO)cc2O)nc1-c1ccccc1.
What is the InChIKey of 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide?
The InChIKey is HATYTBSIIRGDEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O.C18H18N2O2.2C17H16N2O2/c1-12-17(14-6-4-3-5-7-14)21-18(19-12)15-8-10-16(11-9-15)20-13(2)22;1-12-17(14-5-3-2-4-6-14)20-18(19-12)16-8-7-13(10-21)9-15(16)11-22;1-11-16(13-5-3-2-4-6-13)19-17(18-11)14-8-7-12(10-20)9-15(14)21;1-11-16(12-5-3-2-4-6-12)19-17(18-11)13-7-8-14(10-20)15(21)9-13/h3-11H,1-2H3,(H,19,21)(H,20,22);2-9,21-22H,10-11H2,1H3,(H,19,20);2*2-9,20-21H,10H2,1H3,(H,18,19).
What are the key properties of 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide?
2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide has a molecular weight of 1146.36 g/mol, XLogP of 13.55, 13 rotatable bonds, 11 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-5-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;5-(hydroxymethyl)-2-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenol;[3-(hydroxymethyl)-4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methanol;N-[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]acetamide is sourced from PubChem (CID 158423604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).