[4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine

C16H20N2O2 — CID 65051820

IUPAC[4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine
SMILESNCC1(OCc2ccc3ccccc3n2)CCOCC1
InChIInChI=1S/C16H20N2O2/c17-12-16(7-9-19-10-8-16)20-11-14-6-5-13-3-1-2-4-15(13)18-14/h1-6H,7-12,17H2
InChIKeyXAOQJEFDDMSGPO-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.26
Rot. Bonds4

About [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine

[4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine (PubChem CID 65051820) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine.

Molecular Properties

Compound Name[4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine
PubChem CID65051820
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name[4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine
SMILESNCC1(OCc2ccc3ccccc3n2)CCOCC1
InChIInChI=1S/C16H20N2O2/c17-12-16(7-9-19-10-8-16)20-11-14-6-5-13-3-1-2-4-15(13)18-14/h1-6H,7-12,17H2
InChIKeyXAOQJEFDDMSGPO-UHFFFAOYSA-N
XLogP2.26
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-methyl-1-(quinolin-2-ylmethoxy)cyclopentyl]methanamine
CID 65051897
1-(4-aminooxan-4-yl)-2-quinolin-2-ylethanone
CID 116604768
4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine
CID 115757945
(3-phenylmethoxyoxolan-3-yl)methanamine
CID 115025185
[4-(2-phenylethoxy)oxan-4-yl]methanamine
CID 65051705
quinolin-2-ylmethanamine;dihydrochloride
CID 18507294
1-(3-aminooxolan-3-yl)-2-quinolin-2-ylethanone
CID 116579737
4-(chloromethyl)-N-(quinolin-2-ylmethyl)oxan-4-amine
CID 106299799
CID 89210421
CID 89210421
[4-(quinolin-2-ylmethoxy)phenyl]methanamine
CID 28773235
tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane
CID 54324291
[4-(3,4-dihydro-2H-chromen-4-ylmethoxy)oxan-4-yl]methanamine
CID 104768026

Frequently Asked Questions

What is the IUPAC name of [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine?
The IUPAC name of [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine (CID 65051820) is [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine.
What is the SMILES notation for [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine?
The canonical SMILES for [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine is NCC1(OCc2ccc3ccccc3n2)CCOCC1.
What is the InChIKey of [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine?
The InChIKey is XAOQJEFDDMSGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c17-12-16(7-9-19-10-8-16)20-11-14-6-5-13-3-1-2-4-15(13)18-14/h1-6H,7-12,17H2.
What are the key properties of [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine?
[4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine has a molecular weight of 272.35 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine is sourced from PubChem (CID 65051820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).