4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol

C22H19N3O — CID 95120357

IUPAC4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol
SMILESC[C@H](c1ccc(O)cc1)n1cnc(-c2ccccc2)c1-c1cccnc1
InChIInChI=1S/C22H19N3O/c1-16(17-9-11-20(26)12-10-17)25-15-24-21(18-6-3-2-4-7-18)22(25)19-8-5-13-23-14-19/h2-16,26H,1H3/t16-/m1/s1
InChIKeyMBWXXIDDTCFBRH-MRXNPFEDSA-N
MW341.41 g/mol
LogP4.93
Rot. Bonds4

About 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol

4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol (PubChem CID 95120357) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol.

Molecular Properties

Compound Name4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol
PubChem CID95120357
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC Name4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol
SMILESC[C@H](c1ccc(O)cc1)n1cnc(-c2ccccc2)c1-c1cccnc1
InChIInChI=1S/C22H19N3O/c1-16(17-9-11-20(26)12-10-17)25-15-24-21(18-6-3-2-4-7-18)22(25)19-8-5-13-23-14-19/h2-16,26H,1H3/t16-/m1/s1
InChIKeyMBWXXIDDTCFBRH-MRXNPFEDSA-N
XLogP4.93
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol?
The IUPAC name of 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol (CID 95120357) is 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol.
What is the SMILES notation for 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol?
The canonical SMILES for 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol is C[C@H](c1ccc(O)cc1)n1cnc(-c2ccccc2)c1-c1cccnc1.
What is the InChIKey of 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol?
The InChIKey is MBWXXIDDTCFBRH-MRXNPFEDSA-N. The full InChI is InChI=1S/C22H19N3O/c1-16(17-9-11-20(26)12-10-17)25-15-24-21(18-6-3-2-4-7-18)22(25)19-8-5-13-23-14-19/h2-16,26H,1H3/t16-/m1/s1.
What are the key properties of 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol?
4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol has a molecular weight of 341.41 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1R)-1-(4-phenyl-5-pyridin-3-ylimidazol-1-yl)ethyl]phenol is sourced from PubChem (CID 95120357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).