4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol

C22H25N3O2 — CID 82560811

IUPAC4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol
SMILESCN1CCC(Oc2ccc(-c3nccn3Cc3ccc(O)cc3)cc2)CC1
InChIInChI=1S/C22H25N3O2/c1-24-13-10-21(11-14-24)27-20-8-4-18(5-9-20)22-23-12-15-25(22)16-17-2-6-19(26)7-3-17/h2-9,12,15,21,26H,10-11,13-14,16H2,1H3
InChIKeyHMEGDGUVSFYBAA-UHFFFAOYSA-N
MW363.46 g/mol
LogP3.78
Rot. Bonds5

About 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol

4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol (PubChem CID 82560811) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol.

Molecular Properties

Compound Name4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol
PubChem CID82560811
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol
SMILESCN1CCC(Oc2ccc(-c3nccn3Cc3ccc(O)cc3)cc2)CC1
InChIInChI=1S/C22H25N3O2/c1-24-13-10-21(11-14-24)27-20-8-4-18(5-9-20)22-23-12-15-25(22)16-17-2-6-19(26)7-3-17/h2-9,12,15,21,26H,10-11,13-14,16H2,1H3
InChIKeyHMEGDGUVSFYBAA-UHFFFAOYSA-N
XLogP3.78
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[[2-[2-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenyl]methanamine
CID 82559746
4-[1-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-2-yl]pyridine
CID 70780598
[4-(1-methylpiperidin-4-yl)oxyphenyl]methanol
CID 84686879
1-[(4-methylphenyl)methyl]-N-[4-[4-(1-methylpiperidin-4-yl)oxyphenyl]phenyl]triazole-4-carboxamide
CID 122220147
4-(1-methylpiperidin-4-yl)oxypyridine
CID 18723159
N-(4-cyclopentyloxyphenyl)-4-[(2-methylimidazol-1-yl)methyl]benzamide
CID 46775326
4-[[4-(4-methylphenoxy)piperidin-1-yl]methyl]pyridine
CID 90245740
7-hydroxy-3-(4-methylphenyl)-4-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]chromen-2-one
CID 18721853
N-methoxy-1-[4-(1-methylpiperidin-4-yl)oxyphenyl]methanamine
CID 115005034
4-[[2-[4-(dimethylamino)phenyl]imidazol-1-yl]methyl]aniline
CID 82559230
1-[[4-(1-methylpiperidin-4-yl)oxyphenyl]methyl]-3-(3-methyl-2-pyridinyl)thiourea
CID 100748698
2-methyl-4-(1-methylpiperidin-4-yl)oxypyridine
CID 70213870

Frequently Asked Questions

What is the IUPAC name of 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol?
The IUPAC name of 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol (CID 82560811) is 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol.
What is the SMILES notation for 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol?
The canonical SMILES for 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol is CN1CCC(Oc2ccc(-c3nccn3Cc3ccc(O)cc3)cc2)CC1.
What is the InChIKey of 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol?
The InChIKey is HMEGDGUVSFYBAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-24-13-10-21(11-14-24)27-20-8-4-18(5-9-20)22-23-12-15-25(22)16-17-2-6-19(26)7-3-17/h2-9,12,15,21,26H,10-11,13-14,16H2,1H3.
What are the key properties of 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol?
4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol has a molecular weight of 363.46 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-[4-(1-methylpiperidin-4-yl)oxyphenyl]imidazol-1-yl]methyl]phenol is sourced from PubChem (CID 82560811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).