3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol

C19H14N2O — CID 137246748

IUPAC3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol
SMILESOc1cc2c(cc1/N=C/c1ccccn1)-c1ccccc1C2
InChIInChI=1S/C19H14N2O/c22-19-10-14-9-13-5-1-2-7-16(13)17(14)11-18(19)21-12-15-6-3-4-8-20-15/h1-8,10-12,22H,9H2/b21-12+
InChIKeyWXASVFDRZWZBSU-CIAFOILYSA-N
MW286.33 g/mol
LogP4.11
Rot. Bonds2

About 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol

3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol (PubChem CID 137246748) has the molecular formula C19H14N2O and a molecular weight of 286.33 g/mol. Its IUPAC name is 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol.

Molecular Properties

Compound Name3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol
PubChem CID137246748
Molecular FormulaC19H14N2O
Molecular Weight286.33 g/mol
Exact Mass286.11
IUPAC Name3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol
SMILESOc1cc2c(cc1/N=C/c1ccccn1)-c1ccccc1C2
InChIInChI=1S/C19H14N2O/c22-19-10-14-9-13-5-1-2-7-16(13)17(14)11-18(19)21-12-15-6-3-4-8-20-15/h1-8,10-12,22H,9H2/b21-12+
InChIKeyWXASVFDRZWZBSU-CIAFOILYSA-N
XLogP4.11
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol?
The IUPAC name of 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol (CID 137246748) is 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol.
What is the SMILES notation for 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol?
The canonical SMILES for 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol is Oc1cc2c(cc1/N=C/c1ccccn1)-c1ccccc1C2.
What is the InChIKey of 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol?
The InChIKey is WXASVFDRZWZBSU-CIAFOILYSA-N. The full InChI is InChI=1S/C19H14N2O/c22-19-10-14-9-13-5-1-2-7-16(13)17(14)11-18(19)21-12-15-6-3-4-8-20-15/h1-8,10-12,22H,9H2/b21-12+.
What are the key properties of 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol?
3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol has a molecular weight of 286.33 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(pyridin-2-ylmethylideneamino)-9H-fluoren-2-ol is sourced from PubChem (CID 137246748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).