N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide

C18H26N4O2 — CID 46295469

IUPACN-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide
SMILESCCN(CC)CCCNC(=O)Cn1c(=O)c(C)nc2ccccc21
InChIInChI=1S/C18H26N4O2/c1-4-21(5-2)12-8-11-19-17(23)13-22-16-10-7-6-9-15(16)20-14(3)18(22)24/h6-7,9-10H,4-5,8,11-13H2,1-3H3,(H,19,23)
InChIKeyZWFGBGPFHUEOFF-UHFFFAOYSA-N
MW330.43 g/mol
LogP1.55
Rot. Bonds8

About N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide

N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide (PubChem CID 46295469) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide
PubChem CID46295469
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC NameN-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide
SMILESCCN(CC)CCCNC(=O)Cn1c(=O)c(C)nc2ccccc21
InChIInChI=1S/C18H26N4O2/c1-4-21(5-2)12-8-11-19-17(23)13-22-16-10-7-6-9-15(16)20-14(3)18(22)24/h6-7,9-10H,4-5,8,11-13H2,1-3H3,(H,19,23)
InChIKeyZWFGBGPFHUEOFF-UHFFFAOYSA-N
XLogP1.55
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(diethylamino)propyl]-2-(3,6,7-trimethyl-2-oxoquinoxalin-1-yl)acetamide
CID 50768123
N-[3-(diethylamino)propyl]-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide
CID 46356945
2-(3-methyl-2-oxoquinoxalin-1-yl)acetohydrazide
CID 14616290
2-(3-methyl-2-oxoquinoxalin-1-yl)-N-[3-(4-phenylpiperazin-1-yl)propyl]acetamide
CID 46295505
N-[(4-chlorophenyl)methyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide
CID 46295466
N-[2-(dimethylamino)ethyl]-3-(3-methyl-2-oxoquinoxalin-1-yl)propanamide
CID 46324347
3-(3-methyl-2-oxoquinoxalin-1-yl)-N-[3-(4-propylpiperazin-1-yl)propyl]propanamide
CID 46324456
N-[3-(N-ethylanilino)propyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 31591027
1-ethyl-3-methylquinoxalin-2-one
CID 139075519
N-[2,6-di(propan-2-yl)phenyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide
CID 39967043
N-[(2-chlorophenyl)methylideneamino]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide
CID 75150430
2-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]-N-[2-(diethylamino)ethyl]acetamide
CID 112759773

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide?
The IUPAC name of N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide (CID 46295469) is N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide.
What is the SMILES notation for N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide?
The canonical SMILES for N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide is CCN(CC)CCCNC(=O)Cn1c(=O)c(C)nc2ccccc21.
What is the InChIKey of N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide?
The InChIKey is ZWFGBGPFHUEOFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-4-21(5-2)12-8-11-19-17(23)13-22-16-10-7-6-9-15(16)20-14(3)18(22)24/h6-7,9-10H,4-5,8,11-13H2,1-3H3,(H,19,23).
What are the key properties of N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide?
N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide has a molecular weight of 330.43 g/mol, XLogP of 1.55, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylamino)propyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide is sourced from PubChem (CID 46295469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).