5-methoxycyclobuta[b]quinoxaline-1,2-diol

C11H8N2O3 — CID 146025256

IUPAC5-methoxycyclobuta[b]quinoxaline-1,2-diol
SMILESCOc1ccc2nc3c(nc2c1)C(O)=C3O
InChIInChI=1S/C11H8N2O3/c1-16-5-2-3-6-7(4-5)13-9-8(12-6)10(14)11(9)15/h2-4,14-15H,1H3
InChIKeyIOTIMHNVONPJDF-UHFFFAOYSA-N
MW216.20 g/mol
LogP1.89
Rot. Bonds1

About 5-methoxycyclobuta[b]quinoxaline-1,2-diol

5-methoxycyclobuta[b]quinoxaline-1,2-diol (PubChem CID 146025256) has the molecular formula C11H8N2O3 and a molecular weight of 216.20 g/mol. Its IUPAC name is 5-methoxycyclobuta[b]quinoxaline-1,2-diol.

Molecular Properties

Compound Name5-methoxycyclobuta[b]quinoxaline-1,2-diol
PubChem CID146025256
Molecular FormulaC11H8N2O3
Molecular Weight216.20 g/mol
Exact Mass216.05
IUPAC Name5-methoxycyclobuta[b]quinoxaline-1,2-diol
SMILESCOc1ccc2nc3c(nc2c1)C(O)=C3O
InChIInChI=1S/C11H8N2O3/c1-16-5-2-3-6-7(4-5)13-9-8(12-6)10(14)11(9)15/h2-4,14-15H,1H3
InChIKeyIOTIMHNVONPJDF-UHFFFAOYSA-N
XLogP1.89
TPSA75.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(hydroxyamino)-6-methoxyquinoxalin-2-yl]hydroxylamine
CID 135778350
8-methoxyphenazin-1-ol
CID 138967481
6-methoxy-3-methyl-2-phenylquinoxaline
CID 15500862
3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline
CID 58883088
6-methoxy-2-phenylpyrrolo[3,4-b]quinoxaline-1,3-dione
CID 15417894
5-fluorocyclobuta[b]quinoxaline-1,2-diol
CID 135502848
6-methoxy-N,N-dimethyl-3-methylsulfanylquinoxalin-2-amine
CID 118726440
(3,7-dimethoxyquinoxalin-2-yl)carbamic acid
CID 90770827
6-methoxy-2,4-dimethylquinolin-3-ol
CID 123803220
6-methoxy-2H-1,2,4-benzotriazin-3-one
CID 68817274
6-methoxy-2-N,3-N-bis[4-(trifluoromethoxy)phenyl]quinoxaline-2,3-diamine
CID 155541028
ethyl 1,2-dihydroxycyclobuta[b]quinoxaline-5-carboxylate
CID 135479169

Frequently Asked Questions

What is the IUPAC name of 5-methoxycyclobuta[b]quinoxaline-1,2-diol?
The IUPAC name of 5-methoxycyclobuta[b]quinoxaline-1,2-diol (CID 146025256) is 5-methoxycyclobuta[b]quinoxaline-1,2-diol.
What is the SMILES notation for 5-methoxycyclobuta[b]quinoxaline-1,2-diol?
The canonical SMILES for 5-methoxycyclobuta[b]quinoxaline-1,2-diol is COc1ccc2nc3c(nc2c1)C(O)=C3O.
What is the InChIKey of 5-methoxycyclobuta[b]quinoxaline-1,2-diol?
The InChIKey is IOTIMHNVONPJDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O3/c1-16-5-2-3-6-7(4-5)13-9-8(12-6)10(14)11(9)15/h2-4,14-15H,1H3.
What are the key properties of 5-methoxycyclobuta[b]quinoxaline-1,2-diol?
5-methoxycyclobuta[b]quinoxaline-1,2-diol has a molecular weight of 216.20 g/mol, XLogP of 1.89, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxycyclobuta[b]quinoxaline-1,2-diol is sourced from PubChem (CID 146025256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).