N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide

C18H17N3O3 — CID 2469453

IUPACN-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide
SMILESCOc1cccc(NC(=O)COc2nc3ccccc3nc2C)c1
InChIInChI=1S/C18H17N3O3/c1-12-18(21-16-9-4-3-8-15(16)19-12)24-11-17(22)20-13-6-5-7-14(10-13)23-2/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyCFDIRQBDPRRAES-UHFFFAOYSA-N
MW323.35 g/mol
LogP2.96
Rot. Bonds5

About N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide

N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide (PubChem CID 2469453) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide
PubChem CID2469453
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide
SMILESCOc1cccc(NC(=O)COc2nc3ccccc3nc2C)c1
InChIInChI=1S/C18H17N3O3/c1-12-18(21-16-9-4-3-8-15(16)19-12)24-11-17(22)20-13-6-5-7-14(10-13)23-2/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyCFDIRQBDPRRAES-UHFFFAOYSA-N
XLogP2.96
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide (CID 2469453) is N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide is COc1cccc(NC(=O)COc2nc3ccccc3nc2C)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide?
The InChIKey is CFDIRQBDPRRAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-12-18(21-16-9-4-3-8-15(16)19-12)24-11-17(22)20-13-6-5-7-14(10-13)23-2/h3-10H,11H2,1-2H3,(H,20,22).
What are the key properties of N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide?
N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide has a molecular weight of 323.35 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(3-methylquinoxalin-2-yl)oxyacetamide is sourced from PubChem (CID 2469453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).