N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide

C17H22N2O — CID 110487124

IUPACN,N-diethyl-3-(8-methylquinolin-2-yl)propanamide
SMILESCCN(CC)C(=O)CCc1ccc2cccc(C)c2n1
InChIInChI=1S/C17H22N2O/c1-4-19(5-2)16(20)12-11-15-10-9-14-8-6-7-13(3)17(14)18-15/h6-10H,4-5,11-12H2,1-3H3
InChIKeyQWMYZANCUQEWMY-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.34
Rot. Bonds5

About N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide

N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide (PubChem CID 110487124) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide.

Molecular Properties

Compound NameN,N-diethyl-3-(8-methylquinolin-2-yl)propanamide
PubChem CID110487124
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN,N-diethyl-3-(8-methylquinolin-2-yl)propanamide
SMILESCCN(CC)C(=O)CCc1ccc2cccc(C)c2n1
InChIInChI=1S/C17H22N2O/c1-4-19(5-2)16(20)12-11-15-10-9-14-8-6-7-13(3)17(14)18-15/h6-10H,4-5,11-12H2,1-3H3
InChIKeyQWMYZANCUQEWMY-UHFFFAOYSA-N
XLogP3.34
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide?
The IUPAC name of N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide (CID 110487124) is N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide.
What is the SMILES notation for N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide?
The canonical SMILES for N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide is CCN(CC)C(=O)CCc1ccc2cccc(C)c2n1.
What is the InChIKey of N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide?
The InChIKey is QWMYZANCUQEWMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-4-19(5-2)16(20)12-11-15-10-9-14-8-6-7-13(3)17(14)18-15/h6-10H,4-5,11-12H2,1-3H3.
What are the key properties of N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide?
N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide has a molecular weight of 270.38 g/mol, XLogP of 3.34, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(8-methylquinolin-2-yl)propanamide is sourced from PubChem (CID 110487124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).