4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol

C18H13N3O — CID 170762429

IUPAC4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol
SMILESOc1cnccc1-c1[nH]c2cccnc2c1-c1ccccc1
InChIInChI=1S/C18H13N3O/c22-15-11-19-10-8-13(15)17-16(12-5-2-1-3-6-12)18-14(21-17)7-4-9-20-18/h1-11,21-22H
InChIKeyZKITUCOMBLFXMI-UHFFFAOYSA-N
MW287.32 g/mol
LogP4.00
Rot. Bonds2

About 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol

4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol (PubChem CID 170762429) has the molecular formula C18H13N3O and a molecular weight of 287.32 g/mol. Its IUPAC name is 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol.

Molecular Properties

Compound Name4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol
PubChem CID170762429
Molecular FormulaC18H13N3O
Molecular Weight287.32 g/mol
Exact Mass287.11
IUPAC Name4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol
SMILESOc1cnccc1-c1[nH]c2cccnc2c1-c1ccccc1
InChIInChI=1S/C18H13N3O/c22-15-11-19-10-8-13(15)17-16(12-5-2-1-3-6-12)18-14(21-17)7-4-9-20-18/h1-11,21-22H
InChIKeyZKITUCOMBLFXMI-UHFFFAOYSA-N
XLogP4.00
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[[4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-3-pyridinyl]oxy]propan-1-amine;hydrochloride
CID 170762186
2-[3-[[(2S,4S)-4-fluoropyrrolidin-2-yl]methoxy]-4-pyridinyl]-3-phenyl-1H-pyrrolo[3,2-b]pyridine
CID 170762541
N-[2-[[4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-3-pyridinyl]oxy]propyl]prop-2-enamide
CID 170762523
1-[(3R)-3-[[4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-3-pyridinyl]oxy]pyrrolidin-1-yl]prop-2-en-1-one
CID 170762149
1-[(2S,4S)-4-bromo-2-[[4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-3-pyridinyl]oxymethyl]pyrrolidin-1-yl]prop-2-en-1-one
CID 170762355
tert-butyl (2S)-2-[[4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-3-pyridinyl]oxymethyl]-2,5-dihydropyrrole-1-carboxylate
CID 170762464
N-methyl-N-[2-[[4-[3-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,2-b]pyridin-2-yl]-3-pyridinyl]oxy]ethyl]prop-2-enamide
CID 170762251
4,5-diphenyl-3,7,10,12-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1,4,6,8,11(16),12,14-heptaene
CID 144569350
11-phenyl-6H-indolo[2,3-b][1,5]naphthyridine
CID 10541908
2-[3-[[(2S)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]-3-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,2-b]pyridine
CID 170762389
bis(5-phenylquinolin-8-ol);zinc
CID 59818569
6-phenyl-3,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 15319205

Frequently Asked Questions

What is the IUPAC name of 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol?
The IUPAC name of 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol (CID 170762429) is 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol.
What is the SMILES notation for 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol?
The canonical SMILES for 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol is Oc1cnccc1-c1[nH]c2cccnc2c1-c1ccccc1.
What is the InChIKey of 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol?
The InChIKey is ZKITUCOMBLFXMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O/c22-15-11-19-10-8-13(15)17-16(12-5-2-1-3-6-12)18-14(21-17)7-4-9-20-18/h1-11,21-22H.
What are the key properties of 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol?
4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol has a molecular weight of 287.32 g/mol, XLogP of 4.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenyl-1H-pyrrolo[3,2-b]pyridin-2-yl)pyridin-3-ol is sourced from PubChem (CID 170762429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).