2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol

C23H24N4O2 — CID 50971531

IUPAC2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol
SMILESCOc1cc(-c2c(-c3ccccc3)ncn2CCCn2ccc(C)n2)ccc1O
InChIInChI=1S/C23H24N4O2/c1-17-11-14-27(25-17)13-6-12-26-16-24-22(18-7-4-3-5-8-18)23(26)19-9-10-20(28)21(15-19)29-2/h3-5,7-11,14-16,28H,6,12-13H2,1-2H3
InChIKeySWWYCNIBDZTUFL-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.53
Rot. Bonds7

About 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol

2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol (PubChem CID 50971531) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol
PubChem CID50971531
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol
SMILESCOc1cc(-c2c(-c3ccccc3)ncn2CCCn2ccc(C)n2)ccc1O
InChIInChI=1S/C23H24N4O2/c1-17-11-14-27(25-17)13-6-12-26-16-24-22(18-7-4-3-5-8-18)23(26)19-9-10-20(28)21(15-19)29-2/h3-5,7-11,14-16,28H,6,12-13H2,1-2H3
InChIKeySWWYCNIBDZTUFL-UHFFFAOYSA-N
XLogP4.53
TPSA65.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]-4-phenylimidazol-1-yl]ethanol
CID 50977500
4-[3-[4-(methylamino)butyl]-5-phenylimidazol-4-yl]phenol
CID 50978507
1-[3-[(3-methoxy-4-phenylmethoxyphenyl)methoxy]propyl]-4,5-diphenylimidazole
CID 10229029
4-[3-(3-hydroxypropyl)-5-(4-methoxyphenyl)imidazol-4-yl]phenol
CID 10592065
4,5-diphenyl-1-propylimidazole
CID 14950648
1-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-(3-ethoxy-4-methoxyphenyl)-4-phenylimidazole
CID 50967045
5-(3,4-dimethoxyphenyl)-1-[[(2S)-oxan-2-yl]methyl]-4-phenylimidazole
CID 95138059
1-[5-[(3-methoxy-4-phenylmethoxyphenyl)methoxy]pentyl]-4,5-diphenylimidazole
CID 10186869
1-[3-(3-ethoxypropoxy)propyl]-4,5-diphenylimidazole
CID 10133391
1-[3-[(3-methoxyphenyl)methoxy]propyl]-4,5-diphenylimidazole
CID 10179002
methyl 4-[5-(4-cyanophenyl)-4-phenylimidazol-1-yl]butanoate
CID 50952859
1-butyl-4-[4-(trifluoromethyl)phenyl]-5-(3,4,5-trimethoxyphenyl)imidazole
CID 90114849

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol?
The IUPAC name of 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol (CID 50971531) is 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol.
What is the SMILES notation for 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol?
The canonical SMILES for 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol is COc1cc(-c2c(-c3ccccc3)ncn2CCCn2ccc(C)n2)ccc1O.
What is the InChIKey of 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol?
The InChIKey is SWWYCNIBDZTUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-17-11-14-27(25-17)13-6-12-26-16-24-22(18-7-4-3-5-8-18)23(26)19-9-10-20(28)21(15-19)29-2/h3-5,7-11,14-16,28H,6,12-13H2,1-2H3.
What are the key properties of 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol?
2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol has a molecular weight of 388.47 g/mol, XLogP of 4.53, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[3-[3-(3-methylpyrazol-1-yl)propyl]-5-phenylimidazol-4-yl]phenol is sourced from PubChem (CID 50971531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).