3-amino-1,2-dihydroquinoline-2,4-diol

C9H10N2O2 — CID 110273019

IUPAC3-amino-1,2-dihydroquinoline-2,4-diol
SMILESNC1=C(O)c2ccccc2NC1O
InChIInChI=1S/C9H10N2O2/c10-7-8(12)5-3-1-2-4-6(5)11-9(7)13/h1-4,9,11-13H,10H2
InChIKeyFGSNEDLWIJFHKR-UHFFFAOYSA-N
MW178.19 g/mol
LogP0.62
Rot. Bonds

About 3-amino-1,2-dihydroquinoline-2,4-diol

3-amino-1,2-dihydroquinoline-2,4-diol (PubChem CID 110273019) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is 3-amino-1,2-dihydroquinoline-2,4-diol.

Molecular Properties

Compound Name3-amino-1,2-dihydroquinoline-2,4-diol
PubChem CID110273019
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Name3-amino-1,2-dihydroquinoline-2,4-diol
SMILESNC1=C(O)c2ccccc2NC1O
InChIInChI=1S/C9H10N2O2/c10-7-8(12)5-3-1-2-4-6(5)11-9(7)13/h1-4,9,11-13H,10H2
InChIKeyFGSNEDLWIJFHKR-UHFFFAOYSA-N
XLogP0.62
TPSA78.51 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 50.62
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1,2-dihydroquinoline-2,4-diol?
The IUPAC name of 3-amino-1,2-dihydroquinoline-2,4-diol (CID 110273019) is 3-amino-1,2-dihydroquinoline-2,4-diol.
What is the SMILES notation for 3-amino-1,2-dihydroquinoline-2,4-diol?
The canonical SMILES for 3-amino-1,2-dihydroquinoline-2,4-diol is NC1=C(O)c2ccccc2NC1O.
What is the InChIKey of 3-amino-1,2-dihydroquinoline-2,4-diol?
The InChIKey is FGSNEDLWIJFHKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2/c10-7-8(12)5-3-1-2-4-6(5)11-9(7)13/h1-4,9,11-13H,10H2.
What are the key properties of 3-amino-1,2-dihydroquinoline-2,4-diol?
3-amino-1,2-dihydroquinoline-2,4-diol has a molecular weight of 178.19 g/mol, XLogP of 0.62, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1,2-dihydroquinoline-2,4-diol is sourced from PubChem (CID 110273019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).