2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol

C19H14N2O3 — CID 69186236

IUPAC2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol
SMILESOc1cc(Nc2cccnc2)cc(-c2ccoc2)c1-c1ccoc1
InChIInChI=1S/C19H14N2O3/c22-18-9-16(21-15-2-1-5-20-10-15)8-17(13-3-6-23-11-13)19(18)14-4-7-24-12-14/h1-12,21-22H
InChIKeyJBKLWLZNQWXUJA-UHFFFAOYSA-N
MW318.33 g/mol
LogP5.05
Rot. Bonds4

About 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol

2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol (PubChem CID 69186236) has the molecular formula C19H14N2O3 and a molecular weight of 318.33 g/mol. Its IUPAC name is 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol.

Molecular Properties

Compound Name2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol
PubChem CID69186236
Molecular FormulaC19H14N2O3
Molecular Weight318.33 g/mol
Exact Mass318.10
IUPAC Name2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol
SMILESOc1cc(Nc2cccnc2)cc(-c2ccoc2)c1-c1ccoc1
InChIInChI=1S/C19H14N2O3/c22-18-9-16(21-15-2-1-5-20-10-15)8-17(13-3-6-23-11-13)19(18)14-4-7-24-12-14/h1-12,21-22H
InChIKeyJBKLWLZNQWXUJA-UHFFFAOYSA-N
XLogP5.05
TPSA71.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.33
LogP ≤ 55.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-phenyl-2-(pyridin-3-ylamino)phenol
CID 143609614
2-(1,3-dioxol-4-yl)-5-(pyridin-3-ylamino)phenol
CID 69186238
3-(2-chlorophenyl)-5-(pyridin-3-ylamino)phenol
CID 25115111
2-(furan-3-yl)phenol
CID 22723440
3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol
CID 68841722
4-chloro-2-(pyridin-3-ylamino)phenol
CID 102179670
4-(pyridin-3-ylamino)pyridine-2-carboxylic acid
CID 43143000
N-[3-(1,3-dioxol-2-yl)phenyl]pyridin-3-amine
CID 141070937
N-pyridin-3-ylpyrimidin-2-amine
CID 11593513
4-[3-hydroxy-5-(pyridin-3-ylamino)phenyl]-1,3-dihydroindol-2-one
CID 15604182
3-(2,3-dihydro-1H-inden-5-yl)-5-(pyridin-3-ylamino)phenol
CID 15604056
N-(3,4-dimethylphenyl)pyridin-3-amine
CID 82537517

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol?
The IUPAC name of 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol (CID 69186236) is 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol.
What is the SMILES notation for 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol?
The canonical SMILES for 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol is Oc1cc(Nc2cccnc2)cc(-c2ccoc2)c1-c1ccoc1.
What is the InChIKey of 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol?
The InChIKey is JBKLWLZNQWXUJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O3/c22-18-9-16(21-15-2-1-5-20-10-15)8-17(13-3-6-23-11-13)19(18)14-4-7-24-12-14/h1-12,21-22H.
What are the key properties of 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol?
2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol has a molecular weight of 318.33 g/mol, XLogP of 5.05, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(furan-3-yl)-5-(pyridin-3-ylamino)phenol is sourced from PubChem (CID 69186236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).