1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol

C25H20N2O2 — CID 67052878

IUPAC1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol
SMILESOC1=C(c2ccccc2)CNc2ccn(-c3ccc(-c4ccccc4O)cc3)c21
InChIInChI=1S/C25H20N2O2/c28-23-9-5-4-8-20(23)18-10-12-19(13-11-18)27-15-14-22-24(27)25(29)21(16-26-22)17-6-2-1-3-7-17/h1-15,26,28-29H,16H2
InChIKeyCCOVFUQNOCCHOY-UHFFFAOYSA-N
MW380.45 g/mol
LogP5.70
Rot. Bonds3

About 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol

1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol (PubChem CID 67052878) has the molecular formula C25H20N2O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol.

Molecular Properties

Compound Name1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol
PubChem CID67052878
Molecular FormulaC25H20N2O2
Molecular Weight380.45 g/mol
Exact Mass380.15
IUPAC Name1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol
SMILESOC1=C(c2ccccc2)CNc2ccn(-c3ccc(-c4ccccc4O)cc3)c21
InChIInChI=1S/C25H20N2O2/c28-23-9-5-4-8-20(23)18-10-12-19(13-11-18)27-15-14-22-24(27)25(29)21(16-26-22)17-6-2-1-3-7-17/h1-15,26,28-29H,16H2
InChIKeyCCOVFUQNOCCHOY-UHFFFAOYSA-N
XLogP5.70
TPSA57.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.45
LogP ≤ 55.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-1-(4-fluorophenyl)-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol
CID 67052894
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2-[4-[4-(2-hydroxyphenyl)phenyl]phenyl]phenol
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CID 69274449
1,1'-biphenyl;ethanol;2-phenylphenol
CID 90025475
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CID 161060319
2-(3-butyl-4-phenylphenyl)phenol
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1-(4-hydroxyphenyl)-2-phenylpyrrole-3-carboxylic acid
CID 82362678
2-phenyl-5-pyrrolidin-1-ylphenol
CID 91608204

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol?
The IUPAC name of 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol (CID 67052878) is 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol.
What is the SMILES notation for 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol?
The canonical SMILES for 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol is OC1=C(c2ccccc2)CNc2ccn(-c3ccc(-c4ccccc4O)cc3)c21.
What is the InChIKey of 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol?
The InChIKey is CCOVFUQNOCCHOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2O2/c28-23-9-5-4-8-20(23)18-10-12-19(13-11-18)27-15-14-22-24(27)25(29)21(16-26-22)17-6-2-1-3-7-17/h1-15,26,28-29H,16H2.
What are the key properties of 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol?
1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol has a molecular weight of 380.45 g/mol, XLogP of 5.70, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-hydroxyphenyl)phenyl]-6-phenyl-4,5-dihydropyrrolo[3,2-b]pyridin-7-ol is sourced from PubChem (CID 67052878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).