5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol

C10H16FNO2 — CID 144520352

IUPAC5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol
SMILESCCC(O)CCCn1c(O)ccc1F
InChIInChI=1S/C10H16FNO2/c1-2-8(13)4-3-7-12-9(11)5-6-10(12)14/h5-6,8,13-14H,2-4,7H2,1H3
InChIKeyTYZNYWVRGKMIAV-UHFFFAOYSA-N
MW201.24 g/mol
LogP1.88
Rot. Bonds5

About 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol

5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol (PubChem CID 144520352) has the molecular formula C10H16FNO2 and a molecular weight of 201.24 g/mol. Its IUPAC name is 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol.

Molecular Properties

Compound Name5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol
PubChem CID144520352
Molecular FormulaC10H16FNO2
Molecular Weight201.24 g/mol
Exact Mass201.12
IUPAC Name5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol
SMILESCCC(O)CCCn1c(O)ccc1F
InChIInChI=1S/C10H16FNO2/c1-2-8(13)4-3-7-12-9(11)5-6-10(12)14/h5-6,8,13-14H,2-4,7H2,1H3
InChIKeyTYZNYWVRGKMIAV-UHFFFAOYSA-N
XLogP1.88
TPSA45.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.24
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol 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

1-Methylpyrrole-2,5-diol
CID 21326740
1-(Hydroxymethyl)pyrrole-2,5-diol
CID 54060161
1-Ethylpyrrole-2,5-diol
CID 54068298
1-Pentylpyrrole-2,5-diol
CID 54382624
1-(3,4,4-Trifluorobut-3-enyl)pyrrole-2,5-diol
CID 53856482
1-(2,2,2-Trifluoroethyl)pyrrole-2,5-diol
CID 91241711
1-(2,4,4,4-Tetrafluorobut-2-enyl)pyrrole-2,5-diol
CID 123244723
1-(2,2-Difluoroethyl)pyrrole-2,5-diol
CID 123363913
3-(2,5-Dihydroxypyrrol-1-yl)propyl-ethyl-dimethylazanium
CID 53638599
4-(2,5-Dihydroxypyrrol-1-yl)butan-2-one
CID 53647783
1-(3,7-Dimethylocta-2,6-dienyl)pyrrole-2,5-diol
CID 53671195
1-Heptylpyrrole-2,5-diol
CID 53681999

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol?
The IUPAC name of 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol (CID 144520352) is 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol.
What is the SMILES notation for 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol?
The canonical SMILES for 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol is CCC(O)CCCn1c(O)ccc1F.
What is the InChIKey of 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol?
The InChIKey is TYZNYWVRGKMIAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO2/c1-2-8(13)4-3-7-12-9(11)5-6-10(12)14/h5-6,8,13-14H,2-4,7H2,1H3.
What are the key properties of 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol?
5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol has a molecular weight of 201.24 g/mol, XLogP of 1.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-(4-hydroxyhexyl)pyrrol-2-ol is sourced from PubChem (CID 144520352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).