1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol

C10H7FN2O2 — CID 174641483

IUPAC1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol
SMILESOC=C(O)c1cnc2ccc(F)cc2n1
InChIInChI=1S/C10H7FN2O2/c11-6-1-2-7-8(3-6)13-9(4-12-7)10(15)5-14/h1-5,14-15H
InChIKeyNUJZYEFWSHPFHN-UHFFFAOYSA-N
MW206.18 g/mol
LogP2.18
Rot. Bonds1

About 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol

1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol (PubChem CID 174641483) has the molecular formula C10H7FN2O2 and a molecular weight of 206.18 g/mol. Its IUPAC name is 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol.

Molecular Properties

Compound Name1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol
PubChem CID174641483
Molecular FormulaC10H7FN2O2
Molecular Weight206.18 g/mol
Exact Mass206.05
IUPAC Name1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol
SMILESOC=C(O)c1cnc2ccc(F)cc2n1
InChIInChI=1S/C10H7FN2O2/c11-6-1-2-7-8(3-6)13-9(4-12-7)10(15)5-14/h1-5,14-15H
InChIKeyNUJZYEFWSHPFHN-UHFFFAOYSA-N
XLogP2.18
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.18
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

Quinoxaline-2-carboxylic acid
CID 96695
Quinoxalin-2-ylmethanol
CID 905614
1-(2-Quinoxalinyl)-1,2,3,4-butanetetrol
CID 260008
5-Fluoro-1,2,3,8-tetrahydrocyclobuta[b]quinoxaline-1,2-dione
CID 135502848
2-Fluoroquinoxaline
CID 10942599
5-Fluoroquinoxaline
CID 643350
2,3-Quinoxalinedimethanol
CID 81515
6,7-Difluoroquinoxaline
CID 917097
Quinoxaline, 2-(1,2,3,4-tetrahydroxybutyl)-, hydrate
CID 3056911
3-Quinoxalin-2-ylprop-2-yn-1-ol
CID 10607536
6-Fluoroquinoxaline
CID 2778340
2-Methyl-6-fluoroquinoxaline
CID 13380850

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol?
The IUPAC name of 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol (CID 174641483) is 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol.
What is the SMILES notation for 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol?
The canonical SMILES for 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol is OC=C(O)c1cnc2ccc(F)cc2n1.
What is the InChIKey of 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol?
The InChIKey is NUJZYEFWSHPFHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2O2/c11-6-1-2-7-8(3-6)13-9(4-12-7)10(15)5-14/h1-5,14-15H.
What are the key properties of 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol?
1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol has a molecular weight of 206.18 g/mol, XLogP of 2.18, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoroquinoxalin-2-yl)ethene-1,2-diol is sourced from PubChem (CID 174641483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).