[4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol

C16H21N3O2 — CID 114776187

IUPAC[4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol
SMILESCC1(C)CN(c2ccc3cc(N)ccc3n2)CC(CO)O1
InChIInChI=1S/C16H21N3O2/c1-16(2)10-19(8-13(9-20)21-16)15-6-3-11-7-12(17)4-5-14(11)18-15/h3-7,13,20H,8-10,17H2,1-2H3
InChIKeyUWEVIDLWCRQQAT-UHFFFAOYSA-N
MW287.36 g/mol
LogP1.79
Rot. Bonds2

About [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol

[4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol (PubChem CID 114776187) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol
PubChem CID114776187
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name[4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol
SMILESCC1(C)CN(c2ccc3cc(N)ccc3n2)CC(CO)O1
InChIInChI=1S/C16H21N3O2/c1-16(2)10-19(8-13(9-20)21-16)15-6-3-11-7-12(17)4-5-14(11)18-15/h3-7,13,20H,8-10,17H2,1-2H3
InChIKeyUWEVIDLWCRQQAT-UHFFFAOYSA-N
XLogP1.79
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol with MolForge

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Related Compounds

[4-(4-amino-6-chloro-2-pyridinyl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114070637
(6,6-dimethyl-4-quinolin-2-ylmorpholin-2-yl)methanamine
CID 114782247
[4-(3-amino-6-chloro-2-pyridinyl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114776247
6-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]pyridine-3-carbaldehyde
CID 114777262
[4-(2-amino-5-fluoropyrimidin-4-yl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114782748
[4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 104969852
[4-[4-[(1R)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 104969828
[6,6-dimethyl-4-[6-methyl-2-(propylamino)pyrimidin-4-yl]morpholin-2-yl]methanol
CID 114782709
4-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-methylbenzaldehyde
CID 114777267
4-amino-3-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]benzamide
CID 114776221
2-ethyl-4-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1H-pyrimidin-6-one
CID 136989146
2-[4-(6-aminoquinolin-2-yl)piperazin-1-yl]ethanol
CID 43501326

Frequently Asked Questions

What is the IUPAC name of [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol?
The IUPAC name of [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol (CID 114776187) is [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol is CC1(C)CN(c2ccc3cc(N)ccc3n2)CC(CO)O1.
What is the InChIKey of [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol?
The InChIKey is UWEVIDLWCRQQAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-16(2)10-19(8-13(9-20)21-16)15-6-3-11-7-12(17)4-5-14(11)18-15/h3-7,13,20H,8-10,17H2,1-2H3.
What are the key properties of [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol?
[4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol has a molecular weight of 287.36 g/mol, XLogP of 1.79, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol is sourced from PubChem (CID 114776187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).