N-quinolin-2-yloxypropan-2-imine

C12H12N2O — CID 134119603

IUPACN-quinolin-2-yloxypropan-2-imine
SMILESCC(C)=NOc1ccc2ccccc2n1
InChIInChI=1S/C12H12N2O/c1-9(2)14-15-12-8-7-10-5-3-4-6-11(10)13-12/h3-8H,1-2H3
InChIKeyBRJJZDNWTKTJHO-UHFFFAOYSA-N
MW200.24 g/mol
LogP3.01
Rot. Bonds2

About N-quinolin-2-yloxypropan-2-imine

N-quinolin-2-yloxypropan-2-imine (PubChem CID 134119603) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is N-quinolin-2-yloxypropan-2-imine.

Molecular Properties

Compound NameN-quinolin-2-yloxypropan-2-imine
PubChem CID134119603
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC NameN-quinolin-2-yloxypropan-2-imine
SMILESCC(C)=NOc1ccc2ccccc2n1
InChIInChI=1S/C12H12N2O/c1-9(2)14-15-12-8-7-10-5-3-4-6-11(10)13-12/h3-8H,1-2H3
InChIKeyBRJJZDNWTKTJHO-UHFFFAOYSA-N
XLogP3.01
TPSA34.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

quinolin-2-yl hypofluorite
CID 141219202
phosphane;2-quinolin-2-yloxyquinoline
CID 166708861
quinolin-2-yl hydrogen sulfite
CID 175245480
2-quinolin-2-yloxyethanol
CID 19898678
11-quinolin-2-yloxyundecan-2-one
CID 19898708
2-(3,5-dimethoxyphenoxy)quinoline
CID 175975830
2-methyl-1-quinolin-2-yloxypropan-2-amine
CID 64537198
2-quinolin-2-yloxyethanamine
CID 62348403
(E)-1-quinolin-2-yl-N-[2-[[(E)-1-quinolin-2-ylethylideneamino]oxymethyl]prop-2-enoxy]ethanimine
CID 25265136
2-[2-(2-quinolin-2-yloxyethoxy)ethoxy]ethanol
CID 142628371
2-(4-iodophenoxy)quinoline
CID 60645353
2-aminoacetamide;quinolin-2-yl hydrogen carbonate
CID 22446093

Frequently Asked Questions

What is the IUPAC name of N-quinolin-2-yloxypropan-2-imine?
The IUPAC name of N-quinolin-2-yloxypropan-2-imine (CID 134119603) is N-quinolin-2-yloxypropan-2-imine.
What is the SMILES notation for N-quinolin-2-yloxypropan-2-imine?
The canonical SMILES for N-quinolin-2-yloxypropan-2-imine is CC(C)=NOc1ccc2ccccc2n1.
What is the InChIKey of N-quinolin-2-yloxypropan-2-imine?
The InChIKey is BRJJZDNWTKTJHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-9(2)14-15-12-8-7-10-5-3-4-6-11(10)13-12/h3-8H,1-2H3.
What are the key properties of N-quinolin-2-yloxypropan-2-imine?
N-quinolin-2-yloxypropan-2-imine has a molecular weight of 200.24 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinolin-2-yloxypropan-2-imine is sourced from PubChem (CID 134119603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).