2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide

C17H24N2O2 — CID 110768592

IUPAC2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide
SMILESCCCCCNC(=O)Cc1ccc2c(c1)CCC(=O)N2C
InChIInChI=1S/C17H24N2O2/c1-3-4-5-10-18-16(20)12-13-6-8-15-14(11-13)7-9-17(21)19(15)2/h6,8,11H,3-5,7,9-10,12H2,1-2H3,(H,18,20)
InChIKeyRKUUJIQWWNTMDI-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.44
Rot. Bonds6

About 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide

2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide (PubChem CID 110768592) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide.

Molecular Properties

Compound Name2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide
PubChem CID110768592
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide
SMILESCCCCCNC(=O)Cc1ccc2c(c1)CCC(=O)N2C
InChIInChI=1S/C17H24N2O2/c1-3-4-5-10-18-16(20)12-13-6-8-15-14(11-13)7-9-17(21)19(15)2/h6,8,11H,3-5,7,9-10,12H2,1-2H3,(H,18,20)
InChIKeyRKUUJIQWWNTMDI-UHFFFAOYSA-N
XLogP2.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(dimethylamino)ethyl]-2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)acetamide
CID 110768552
N-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)methyl]butanamide
CID 110781637
2-(5-methyl-4-oxo-2,3-dihydro-1,5-benzoxazepin-7-yl)-N-pentylacetamide
CID 110770862
N-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)methyl]-2-(4-methylphenyl)acetamide
CID 110781697
N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]-2-(2-methylphenyl)acetamide
CID 110788734
N-cyclopentyl-2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)acetamide
CID 110768543
N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]-2-oxoacetamide
CID 115166541
N-(2-aminoethyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
CID 82295802
2,2-dimethyl-N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]propanamide
CID 110788697
4-chloro-N-[2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)ethyl]benzamide
CID 110788721
6-(2-hydroxy-2-methylpropyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 116928650
6-[2-(hydroxymethylamino)ethyl]-1-methyl-3,4-dihydroquinolin-2-one
CID 115229304

Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide?
The IUPAC name of 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide (CID 110768592) is 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide.
What is the SMILES notation for 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide?
The canonical SMILES for 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide is CCCCCNC(=O)Cc1ccc2c(c1)CCC(=O)N2C.
What is the InChIKey of 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide?
The InChIKey is RKUUJIQWWNTMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-3-4-5-10-18-16(20)12-13-6-8-15-14(11-13)7-9-17(21)19(15)2/h6,8,11H,3-5,7,9-10,12H2,1-2H3,(H,18,20).
What are the key properties of 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide?
2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide has a molecular weight of 288.39 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-N-pentylacetamide is sourced from PubChem (CID 110768592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).