2-[(6-aminoquinolin-2-yl)amino]ethanol

C11H13N3O — CID 43450889

IUPAC2-[(6-aminoquinolin-2-yl)amino]ethanol
SMILESNc1ccc2nc(NCCO)ccc2c1
InChIInChI=1S/C11H13N3O/c12-9-2-3-10-8(7-9)1-4-11(14-10)13-5-6-15/h1-4,7,15H,5-6,12H2,(H,13,14)
InChIKeyCEZVVSVKLHXQPL-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.22
Rot. Bonds3

About 2-[(6-aminoquinolin-2-yl)amino]ethanol

2-[(6-aminoquinolin-2-yl)amino]ethanol (PubChem CID 43450889) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 2-[(6-aminoquinolin-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-aminoquinolin-2-yl)amino]ethanol
PubChem CID43450889
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name2-[(6-aminoquinolin-2-yl)amino]ethanol
SMILESNc1ccc2nc(NCCO)ccc2c1
InChIInChI=1S/C11H13N3O/c12-9-2-3-10-8(7-9)1-4-11(14-10)13-5-6-15/h1-4,7,15H,5-6,12H2,(H,13,14)
InChIKeyCEZVVSVKLHXQPL-UHFFFAOYSA-N
XLogP1.22
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-[(6-aminoquinolin-2-yl)amino]propane-1,2-diol
CID 66175697
2-N-[2-(1,3-thiazol-2-yl)ethyl]quinoline-2,6-diamine
CID 55176380
2-N-(pyridin-4-ylmethyl)quinoline-2,6-diamine
CID 43450886
2-N-[(4-fluorophenyl)methyl]quinoline-2,6-diamine
CID 43450871
2-[[(6-aminoquinolin-2-yl)amino]methyl]cyclohexan-1-ol
CID 64929609
2-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-2,6-diamine
CID 62039822
2-(6-aminoquinolin-2-yl)-N-(2-hydroxyethyl)acetamide
CID 82547456
2-N-[(4-methoxyphenyl)methyl]quinoline-2,6-diamine
CID 43450854
(6-aminoquinolin-2-yl)methanol
CID 22763701
2-N-[(4,5-dimethylthiophen-2-yl)methyl]quinoline-2,6-diamine
CID 65246656
2-N-[(5-methylthiophen-2-yl)methyl]quinoline-2,6-diamine
CID 62057050
6-[(6-bromoquinolin-2-yl)amino]hexan-1-ol
CID 133434464

Frequently Asked Questions

What is the IUPAC name of 2-[(6-aminoquinolin-2-yl)amino]ethanol?
The IUPAC name of 2-[(6-aminoquinolin-2-yl)amino]ethanol (CID 43450889) is 2-[(6-aminoquinolin-2-yl)amino]ethanol.
What is the SMILES notation for 2-[(6-aminoquinolin-2-yl)amino]ethanol?
The canonical SMILES for 2-[(6-aminoquinolin-2-yl)amino]ethanol is Nc1ccc2nc(NCCO)ccc2c1.
What is the InChIKey of 2-[(6-aminoquinolin-2-yl)amino]ethanol?
The InChIKey is CEZVVSVKLHXQPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c12-9-2-3-10-8(7-9)1-4-11(14-10)13-5-6-15/h1-4,7,15H,5-6,12H2,(H,13,14).
What are the key properties of 2-[(6-aminoquinolin-2-yl)amino]ethanol?
2-[(6-aminoquinolin-2-yl)amino]ethanol has a molecular weight of 203.25 g/mol, XLogP of 1.22, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-aminoquinolin-2-yl)amino]ethanol is sourced from PubChem (CID 43450889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).