9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene

C25H20 — CID 91048021

IUPAC9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene
SMILESC=CCC1C=C(C2c3ccccc3-c3ccccc32)c2ccccc21
InChIInChI=1S/C25H20/c1-2-9-17-16-24(19-11-4-3-10-18(17)19)25-22-14-7-5-12-20(22)21-13-6-8-15-23(21)25/h2-8,10-17,25H,1,9H2
InChIKeyPMRTWWQROIIEGS-UHFFFAOYSA-N
MW320.44 g/mol
LogP6.56
Rot. Bonds3

About 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene

9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene (PubChem CID 91048021) has the molecular formula C25H20 and a molecular weight of 320.44 g/mol. Its IUPAC name is 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene.

Molecular Properties

Compound Name9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene
PubChem CID91048021
Molecular FormulaC25H20
Molecular Weight320.44 g/mol
Exact Mass320.16
IUPAC Name9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene
SMILESC=CCC1C=C(C2c3ccccc3-c3ccccc32)c2ccccc21
InChIInChI=1S/C25H20/c1-2-9-17-16-24(19-11-4-3-10-18(17)19)25-22-14-7-5-12-20(22)21-13-6-8-15-23(21)25/h2-8,10-17,25H,1,9H2
InChIKeyPMRTWWQROIIEGS-UHFFFAOYSA-N
XLogP6.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.44
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene 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

9-[2-(3-prop-2-enyl-1H-inden-1-yl)ethyl]-9H-fluorene
CID 15899658
trimethyl-[(E)-(4-prop-2-enyl-4H-naphthalen-1-ylidene)methyl]silane
CID 164679289
N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine
CID 123301084
4-(9H-fluoren-9-yl)-2-prop-2-enylphenol
CID 67926728
9-phenyl-9H-fluorene
CID 13091
9-methyl-9H-fluorene;prop-1-ene
CID 145012304
[3-[(1Z)-buta-1,3-dienyl]-1H-inden-1-yl]methanol
CID 142274342
1-phenyl-2-(4-prop-2-enylcyclohexyl)benzene
CID 174875446
9H-fluoren-9-yl-dimethyl-(1-prop-2-enyl-1H-inden-2-yl)silane
CID 56625000
ethane;ethenol;9-ethyl-9H-fluorene
CID 142934939
1-O-(9H-fluoren-9-ylmethyl) 3-O-prop-2-enyl 2-amino-2-(iodomethyl)propanedioate
CID 175014630
2-(9H-fluoren-9-yl)-1H-pyrrole
CID 57142486

Frequently Asked Questions

What is the IUPAC name of 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene?
The IUPAC name of 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene (CID 91048021) is 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene.
What is the SMILES notation for 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene?
The canonical SMILES for 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene is C=CCC1C=C(C2c3ccccc3-c3ccccc32)c2ccccc21.
What is the InChIKey of 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene?
The InChIKey is PMRTWWQROIIEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20/c1-2-9-17-16-24(19-11-4-3-10-18(17)19)25-22-14-7-5-12-20(22)21-13-6-8-15-23(21)25/h2-8,10-17,25H,1,9H2.
What are the key properties of 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene?
9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene has a molecular weight of 320.44 g/mol, XLogP of 6.56, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene is sourced from PubChem (CID 91048021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).