4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol

C19H19FO2 — CID 14770935

IUPAC4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol
SMILESOC1(c2ccc(F)cc2)CC2(CCCC2)Oc2ccccc21
InChIInChI=1S/C19H19FO2/c20-15-9-7-14(8-10-15)19(21)13-18(11-3-4-12-18)22-17-6-2-1-5-16(17)19/h1-2,5-10,21H,3-4,11-13H2
InChIKeyPUQYGMLUYYSEDG-UHFFFAOYSA-N
MW298.36 g/mol
LogP4.16
Rot. Bonds1

About 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol

4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol (PubChem CID 14770935) has the molecular formula C19H19FO2 and a molecular weight of 298.36 g/mol. Its IUPAC name is 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol.

Molecular Properties

Compound Name4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol
PubChem CID14770935
Molecular FormulaC19H19FO2
Molecular Weight298.36 g/mol
Exact Mass298.14
IUPAC Name4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol
SMILESOC1(c2ccc(F)cc2)CC2(CCCC2)Oc2ccccc21
InChIInChI=1S/C19H19FO2/c20-15-9-7-14(8-10-15)19(21)13-18(11-3-4-12-18)22-17-6-2-1-5-16(17)19/h1-2,5-10,21H,3-4,11-13H2
InChIKeyPUQYGMLUYYSEDG-UHFFFAOYSA-N
XLogP4.16
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol?
The IUPAC name of 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol (CID 14770935) is 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol.
What is the SMILES notation for 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol?
The canonical SMILES for 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol is OC1(c2ccc(F)cc2)CC2(CCCC2)Oc2ccccc21.
What is the InChIKey of 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol?
The InChIKey is PUQYGMLUYYSEDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FO2/c20-15-9-7-14(8-10-15)19(21)13-18(11-3-4-12-18)22-17-6-2-1-5-16(17)19/h1-2,5-10,21H,3-4,11-13H2.
What are the key properties of 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol?
4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol has a molecular weight of 298.36 g/mol, XLogP of 4.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)spiro[3H-chromene-2,1'-cyclopentane]-4-ol is sourced from PubChem (CID 14770935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).