4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol

C30H32N2O3 — CID 16681691

IUPAC4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol
SMILESOc1c(CN2CCOCC2)cc(C=C2c3ccccc3-c3ccccc32)cc1CN1CCOCC1
InChIInChI=1S/C30H32N2O3/c33-30-23(20-31-9-13-34-14-10-31)17-22(18-24(30)21-32-11-15-35-16-12-32)19-29-27-7-3-1-5-25(27)26-6-2-4-8-28(26)29/h1-8,17-19,33H,9-16,20-21H2
InChIKeyPEICCQRRFXCZSL-UHFFFAOYSA-N
MW468.60 g/mol
LogP4.63
Rot. Bonds5

About 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol

4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol (PubChem CID 16681691) has the molecular formula C30H32N2O3 and a molecular weight of 468.60 g/mol. Its IUPAC name is 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol.

Molecular Properties

Compound Name4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol
PubChem CID16681691
Molecular FormulaC30H32N2O3
Molecular Weight468.60 g/mol
Exact Mass468.24
IUPAC Name4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol
SMILESOc1c(CN2CCOCC2)cc(C=C2c3ccccc3-c3ccccc32)cc1CN1CCOCC1
InChIInChI=1S/C30H32N2O3/c33-30-23(20-31-9-13-34-14-10-31)17-22(18-24(30)21-32-11-15-35-16-12-32)19-29-27-7-3-1-5-25(27)26-6-2-4-8-28(26)29/h1-8,17-19,33H,9-16,20-21H2
InChIKeyPEICCQRRFXCZSL-UHFFFAOYSA-N
XLogP4.63
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.60
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methyl-2,6-bis(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)phenol
CID 10462009
3-amino-2,4,6-tris(morpholin-4-ylmethyl)phenol
CID 139658917
4-chloro-2-(morpholin-4-ylmethyl)-6-phenylphenol
CID 23797967
2,6-bis(morpholin-4-ylmethyl)-4-propan-2-ylphenol
CID 3338042
2,4-bis(morpholin-4-ylmethyl)-6-(1,4-oxazepan-4-ylmethyl)phenol
CID 144964322
5-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 168598045
2-(morpholin-4-ylmethyl)-4-[(E)-2-pyridin-2-ylethenyl]phenol
CID 135475870
5-amino-2-(morpholin-4-ylmethyl)phenol
CID 19799808
4-[[2-(1,3-dihydroisoindol-2-ylmethyl)phenyl]methyl]morpholine
CID 13041711
5-[3-[(4-benzylpiperazin-1-yl)methyl]-4-hydroxy-5-(morpholin-4-ylmethyl)phenyl]dithiole-3-thione
CID 139657976
3-(morpholin-4-ylmethyl)-2-phenylphenol
CID 174703576
(3E,5E)-3,5-bis[[4-hydroxy-3-(morpholin-4-ylmethyl)phenyl]methylidene]piperidin-4-one;trihydrochloride
CID 127037835

Frequently Asked Questions

What is the IUPAC name of 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol?
The IUPAC name of 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol (CID 16681691) is 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol.
What is the SMILES notation for 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol?
The canonical SMILES for 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol is Oc1c(CN2CCOCC2)cc(C=C2c3ccccc3-c3ccccc32)cc1CN1CCOCC1.
What is the InChIKey of 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol?
The InChIKey is PEICCQRRFXCZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32N2O3/c33-30-23(20-31-9-13-34-14-10-31)17-22(18-24(30)21-32-11-15-35-16-12-32)19-29-27-7-3-1-5-25(27)26-6-2-4-8-28(26)29/h1-8,17-19,33H,9-16,20-21H2.
What are the key properties of 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol?
4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol has a molecular weight of 468.60 g/mol, XLogP of 4.63, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoren-9-ylidenemethyl)-2,6-bis(morpholin-4-ylmethyl)phenol is sourced from PubChem (CID 16681691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).