N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine

C16H20N2O2 — CID 107388346

IUPACN-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine
SMILESCCNC1CC(Oc2cnc3ccccc3c2)C1OC
InChIInChI=1S/C16H20N2O2/c1-3-17-14-9-15(16(14)19-2)20-12-8-11-6-4-5-7-13(11)18-10-12/h4-8,10,14-17H,3,9H2,1-2H3
InChIKeyMYOCSDQMGCVXAM-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.38
Rot. Bonds5

About N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine

N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine (PubChem CID 107388346) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine
PubChem CID107388346
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine
SMILESCCNC1CC(Oc2cnc3ccccc3c2)C1OC
InChIInChI=1S/C16H20N2O2/c1-3-17-14-9-15(16(14)19-2)20-12-8-11-6-4-5-7-13(11)18-10-12/h4-8,10,14-17H,3,9H2,1-2H3
InChIKeyMYOCSDQMGCVXAM-UHFFFAOYSA-N
XLogP2.38
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine?
The IUPAC name of N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine (CID 107388346) is N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine.
What is the SMILES notation for N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine?
The canonical SMILES for N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine is CCNC1CC(Oc2cnc3ccccc3c2)C1OC.
What is the InChIKey of N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine?
The InChIKey is MYOCSDQMGCVXAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-3-17-14-9-15(16(14)19-2)20-12-8-11-6-4-5-7-13(11)18-10-12/h4-8,10,14-17H,3,9H2,1-2H3.
What are the key properties of N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine?
N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine has a molecular weight of 272.35 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-3-quinolin-3-yloxycyclobutan-1-amine is sourced from PubChem (CID 107388346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).