[2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol

C17H16N2O2 — CID 63680015

IUPAC[2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol
SMILESNc1nc2ccccc2cc1COc1ccccc1CO
InChIInChI=1S/C17H16N2O2/c18-17-14(9-12-5-1-3-7-15(12)19-17)11-21-16-8-4-2-6-13(16)10-20/h1-9,20H,10-11H2,(H2,18,19)
InChIKeyFXQRENAOCOGMDS-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.89
Rot. Bonds4

About [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol

[2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol (PubChem CID 63680015) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol
PubChem CID63680015
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name[2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol
SMILESNc1nc2ccccc2cc1COc1ccccc1CO
InChIInChI=1S/C17H16N2O2/c18-17-14(9-12-5-1-3-7-15(12)19-17)11-21-16-8-4-2-6-13(16)10-20/h1-9,20H,10-11H2,(H2,18,19)
InChIKeyFXQRENAOCOGMDS-UHFFFAOYSA-N
XLogP2.89
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol
CID 62188885
3-[(2-ethoxyphenyl)methyl]quinolin-2-amine;hydrochloride
CID 68554141
[2-[3-(hydroxymethyl)quinolin-2-yl]oxyphenyl]methanol
CID 63653966
3-[(2,6-difluorophenoxy)methyl]quinolin-2-amine
CID 81265271
3-[(3-methylphenoxy)methyl]quinolin-2-amine
CID 62193527
[2-(quinolin-6-ylmethoxy)phenyl]methanol
CID 28776532
2-[(2-chloroquinolin-3-yl)methoxy]aniline
CID 61026521
3-(2,2-difluoroethoxymethyl)quinolin-2-amine
CID 82007215
2-[2-[(2-chloroquinolin-4-yl)methoxy]phenyl]acetamide
CID 75511404
3-(cyclohexyloxymethyl)quinolin-2-amine
CID 62194016
[3-(aminomethyl)quinolin-2-yl]methanol
CID 25170623
3-(heptoxymethyl)quinolin-2-amine
CID 62194119

Frequently Asked Questions

What is the IUPAC name of [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol?
The IUPAC name of [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol (CID 63680015) is [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol.
What is the SMILES notation for [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol?
The canonical SMILES for [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol is Nc1nc2ccccc2cc1COc1ccccc1CO.
What is the InChIKey of [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol?
The InChIKey is FXQRENAOCOGMDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c18-17-14(9-12-5-1-3-7-15(12)19-17)11-21-16-8-4-2-6-13(16)10-20/h1-9,20H,10-11H2,(H2,18,19).
What are the key properties of [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol?
[2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol has a molecular weight of 280.33 g/mol, XLogP of 2.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-aminoquinolin-3-yl)methoxy]phenyl]methanol is sourced from PubChem (CID 63680015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).