O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane

C17H25N3O2 — CID 157043155

IUPACO-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane
SMILESCC.CC1CN(c2ccc3nccc(ON)c3c2)CC(C)O1
InChIInChI=1S/C15H19N3O2.C2H6/c1-10-8-18(9-11(2)19-10)12-3-4-14-13(7-12)15(20-16)5-6-17-14;1-2/h3-7,10-11H,8-9,16H2,1-2H3;1-2H3
InChIKeyIBTMKBQONOVNFM-UHFFFAOYSA-N
MW303.41 g/mol
LogP3.13
Rot. Bonds2

About O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane

O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane (PubChem CID 157043155) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane.

Molecular Properties

Compound NameO-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane
PubChem CID157043155
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameO-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane
SMILESCC.CC1CN(c2ccc3nccc(ON)c3c2)CC(C)O1
InChIInChI=1S/C15H19N3O2.C2H6/c1-10-8-18(9-11(2)19-10)12-3-4-14-13(7-12)15(20-16)5-6-17-14;1-2/h3-7,10-11H,8-9,16H2,1-2H3;1-2H3
InChIKeyIBTMKBQONOVNFM-UHFFFAOYSA-N
XLogP3.13
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethane;4-(4-methoxyquinolin-6-yl)-2,6-dimethylmorpholine
CID 157043902
O-[6-(3-fluoroazetidin-1-yl)quinolin-4-yl]hydroxylamine
CID 166834627
2-ethyl-4-(4-methoxyquinolin-6-yl)-6-methylmorpholine
CID 170227184
ethane;O-(6-methoxyquinolin-4-yl)hydroxylamine
CID 157043543
(2S,6R)-2,6-dimethyl-4-[2-(trifluoromethyl)-4-pyridinyl]morpholine
CID 155974206
4-[2-(chloromethyl)-4-pyridinyl]-2,6-dimethylmorpholine
CID 61257388
4-(2,6-dimethylmorpholin-4-yl)pyridine-2-carbonitrile
CID 62491625
5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylaniline
CID 94894664
4-(6-ethyl-3-pyridinyl)-2,6-dimethylmorpholine
CID 121264933
(2S)-2,6-dimethyl-4-(4-methylphenyl)morpholine
CID 166696094
4-butan-2-yloxy-6-(4,4-difluoropiperidin-1-yl)quinoline
CID 170009860
5-(aminomethyl)-3-[4-(4-ethyl-2-methylphenoxy)quinolin-6-yl]-1,3-oxazolidin-2-one
CID 171645852

Frequently Asked Questions

What is the IUPAC name of O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane?
The IUPAC name of O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane (CID 157043155) is O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane.
What is the SMILES notation for O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane?
The canonical SMILES for O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane is CC.CC1CN(c2ccc3nccc(ON)c3c2)CC(C)O1.
What is the InChIKey of O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane?
The InChIKey is IBTMKBQONOVNFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2.C2H6/c1-10-8-18(9-11(2)19-10)12-3-4-14-13(7-12)15(20-16)5-6-17-14;1-2/h3-7,10-11H,8-9,16H2,1-2H3;1-2H3.
What are the key properties of O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane?
O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane has a molecular weight of 303.41 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for O-[6-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]hydroxylamine;ethane is sourced from PubChem (CID 157043155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).