N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide

C13H18N2O2 — CID 43117551

IUPACN-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
SMILESCNC(=O)C(C)Oc1cccc2c1NCCC2
InChIInChI=1S/C13H18N2O2/c1-9(13(16)14-2)17-11-7-3-5-10-6-4-8-15-12(10)11/h3,5,7,9,15H,4,6,8H2,1-2H3,(H,14,16)
InChIKeyIUJFXZXXMYAJHW-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.56
Rot. Bonds3

About N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide

N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide (PubChem CID 43117551) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide.

Molecular Properties

Compound NameN-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
PubChem CID43117551
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
SMILESCNC(=O)C(C)Oc1cccc2c1NCCC2
InChIInChI=1S/C13H18N2O2/c1-9(13(16)14-2)17-11-7-3-5-10-6-4-8-15-12(10)11/h3,5,7,9,15H,4,6,8H2,1-2H3,(H,14,16)
InChIKeyIUJFXZXXMYAJHW-UHFFFAOYSA-N
XLogP1.56
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide?
The IUPAC name of N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide (CID 43117551) is N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide.
What is the SMILES notation for N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide?
The canonical SMILES for N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide is CNC(=O)C(C)Oc1cccc2c1NCCC2.
What is the InChIKey of N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide?
The InChIKey is IUJFXZXXMYAJHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9(13(16)14-2)17-11-7-3-5-10-6-4-8-15-12(10)11/h3,5,7,9,15H,4,6,8H2,1-2H3,(H,14,16).
What are the key properties of N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide?
N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide has a molecular weight of 234.30 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide is sourced from PubChem (CID 43117551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).