4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol

C23H24N4O — CID 95120001

IUPAC4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol
SMILESCc1cc(C)n([C@H](C)Cn2cnc(-c3ccccc3)c2-c2ccc(O)cc2)n1
InChIInChI=1S/C23H24N4O/c1-16-13-17(2)27(25-16)18(3)14-26-15-24-22(19-7-5-4-6-8-19)23(26)20-9-11-21(28)12-10-20/h4-13,15,18,28H,14H2,1-3H3/t18-/m1/s1
InChIKeyXLXNDEBASIQJCU-GOSISDBHSA-N
MW372.47 g/mol
LogP5.00
Rot. Bonds5

About 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol

4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol (PubChem CID 95120001) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol.

Molecular Properties

Compound Name4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol
PubChem CID95120001
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol
SMILESCc1cc(C)n([C@H](C)Cn2cnc(-c3ccccc3)c2-c2ccc(O)cc2)n1
InChIInChI=1S/C23H24N4O/c1-16-13-17(2)27(25-16)18(3)14-26-15-24-22(19-7-5-4-6-8-19)23(26)20-9-11-21(28)12-10-20/h4-13,15,18,28H,14H2,1-3H3/t18-/m1/s1
InChIKeyXLXNDEBASIQJCU-GOSISDBHSA-N
XLogP5.00
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(1S)-2-(4,5-diphenylimidazol-1-yl)-1-phenylethanol
CID 11850984
4-[3-[4-(methylamino)butyl]-5-phenylimidazol-4-yl]phenol
CID 50978507
4,5-diphenyl-1-propylimidazole
CID 14950648
(2S)-3-[5-(2,6-dimethylphenyl)-4-phenylimidazol-1-yl]propane-1,2-diol
CID 95126287
1-carbazol-9-yl-3-(4,5-diphenylimidazol-1-yl)propan-2-ol
CID 2836174
N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]benzamide
CID 7444930
1-[[2-[(4,5-diphenylimidazol-1-yl)methyl]phenyl]methyl]-4,5-diphenylimidazole
CID 15794352
7-[3-(4,5-diphenylimidazol-1-yl)-2-hydroxypropyl]-1,3-dimethylpurine-2,6-dione
CID 3435586
2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol
CID 50971531
3-(3,5-dimethylpyrazol-1-yl)butanamide
CID 130652830
3-(3,5-dimethylpyrazol-1-yl)butanethioamide
CID 60915402
4-[2-(3,5-dimethylpyrazol-1-yl)-6-phenylpyrimidin-4-yl]phenol
CID 137062038

Frequently Asked Questions

What is the IUPAC name of 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol?
The IUPAC name of 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol (CID 95120001) is 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol.
What is the SMILES notation for 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol?
The canonical SMILES for 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol is Cc1cc(C)n([C@H](C)Cn2cnc(-c3ccccc3)c2-c2ccc(O)cc2)n1.
What is the InChIKey of 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol?
The InChIKey is XLXNDEBASIQJCU-GOSISDBHSA-N. The full InChI is InChI=1S/C23H24N4O/c1-16-13-17(2)27(25-16)18(3)14-26-15-24-22(19-7-5-4-6-8-19)23(26)20-9-11-21(28)12-10-20/h4-13,15,18,28H,14H2,1-3H3/t18-/m1/s1.
What are the key properties of 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol?
4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol has a molecular weight of 372.47 g/mol, XLogP of 5.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol is sourced from PubChem (CID 95120001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).