N-(2-methylquinoxalin-6-yl)pentadecanamide

C24H37N3O — CID 44611336

IUPACN-(2-methylquinoxalin-6-yl)pentadecanamide
SMILESCCCCCCCCCCCCCCC(=O)Nc1ccc2nc(C)cnc2c1
InChIInChI=1S/C24H37N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-24(28)27-21-16-17-22-23(18-21)25-19-20(2)26-22/h16-19H,3-15H2,1-2H3,(H,27,28)
InChIKeyDZXJCLKSFOWQGV-UHFFFAOYSA-N
MW383.58 g/mol
LogP6.97
Rot. Bonds14

About N-(2-methylquinoxalin-6-yl)pentadecanamide

N-(2-methylquinoxalin-6-yl)pentadecanamide (PubChem CID 44611336) has the molecular formula C24H37N3O and a molecular weight of 383.58 g/mol. Its IUPAC name is N-(2-methylquinoxalin-6-yl)pentadecanamide.

Molecular Properties

Compound NameN-(2-methylquinoxalin-6-yl)pentadecanamide
PubChem CID44611336
Molecular FormulaC24H37N3O
Molecular Weight383.58 g/mol
Exact Mass383.29
IUPAC NameN-(2-methylquinoxalin-6-yl)pentadecanamide
SMILESCCCCCCCCCCCCCCC(=O)Nc1ccc2nc(C)cnc2c1
InChIInChI=1S/C24H37N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-24(28)27-21-16-17-22-23(18-21)25-19-20(2)26-22/h16-19H,3-15H2,1-2H3,(H,27,28)
InChIKeyDZXJCLKSFOWQGV-UHFFFAOYSA-N
XLogP6.97
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.58
LogP ≤ 56.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methylquinoxalin-6-yl)butanamide
CID 154505426
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
N-(3,4-dimethylphenyl)dodecanamide
CID 4067786
N-(4-hydroxy-3-methylphenyl)tetradecanamide
CID 91054297
N-phenazin-2-ylbutanamide
CID 73349412
N-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)octanamide
CID 43072188
N-(2-chloro-4-pyridinyl)heptanamide
CID 15790514
N-(5-methylpyrazin-2-yl)hexanamide
CID 59059045
N-(4-tert-butylphenyl)dodecanamide
CID 118504435
ethane;N-quinolin-7-ylpentanamide
CID 156648097
N-[4-(heptanoylamino)phenyl]benzamide
CID 54789055
N-(1,3-benzodioxol-5-yl)nonanamide
CID 5213416

Frequently Asked Questions

What is the IUPAC name of N-(2-methylquinoxalin-6-yl)pentadecanamide?
The IUPAC name of N-(2-methylquinoxalin-6-yl)pentadecanamide (CID 44611336) is N-(2-methylquinoxalin-6-yl)pentadecanamide.
What is the SMILES notation for N-(2-methylquinoxalin-6-yl)pentadecanamide?
The canonical SMILES for N-(2-methylquinoxalin-6-yl)pentadecanamide is CCCCCCCCCCCCCCC(=O)Nc1ccc2nc(C)cnc2c1.
What is the InChIKey of N-(2-methylquinoxalin-6-yl)pentadecanamide?
The InChIKey is DZXJCLKSFOWQGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H37N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-24(28)27-21-16-17-22-23(18-21)25-19-20(2)26-22/h16-19H,3-15H2,1-2H3,(H,27,28).
What are the key properties of N-(2-methylquinoxalin-6-yl)pentadecanamide?
N-(2-methylquinoxalin-6-yl)pentadecanamide has a molecular weight of 383.58 g/mol, XLogP of 6.97, 14 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylquinoxalin-6-yl)pentadecanamide is sourced from PubChem (CID 44611336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).