N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide

C15H18N2O2 — CID 10061064

IUPACN-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1ccnc2ccc(OC)cc12
InChIInChI=1S/C15H18N2O2/c1-3-15(18)17-9-7-11-6-8-16-14-5-4-12(19-2)10-13(11)14/h4-6,8,10H,3,7,9H2,1-2H3,(H,17,18)
InChIKeyWLHMPDHUDHJZMH-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.31
Rot. Bonds5

About N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide

N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide (PubChem CID 10061064) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide
PubChem CID10061064
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1ccnc2ccc(OC)cc12
InChIInChI=1S/C15H18N2O2/c1-3-15(18)17-9-7-11-6-8-16-14-5-4-12(19-2)10-13(11)14/h4-6,8,10H,3,7,9H2,1-2H3,(H,17,18)
InChIKeyWLHMPDHUDHJZMH-UHFFFAOYSA-N
XLogP2.31
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide?
The IUPAC name of N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide (CID 10061064) is N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide.
What is the SMILES notation for N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide?
The canonical SMILES for N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide is CCC(=O)NCCc1ccnc2ccc(OC)cc12.
What is the InChIKey of N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide?
The InChIKey is WLHMPDHUDHJZMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-15(18)17-9-7-11-6-8-16-14-5-4-12(19-2)10-13(11)14/h4-6,8,10H,3,7,9H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide?
N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide has a molecular weight of 258.32 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methoxyquinolin-4-yl)ethyl]propanamide is sourced from PubChem (CID 10061064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).