N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide

C14H21N3O — CID 115641411

IUPACN,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
SMILESCCN(CC)C(=O)N1CCN(C)c2ccccc21
InChIInChI=1S/C14H21N3O/c1-4-16(5-2)14(18)17-11-10-15(3)12-8-6-7-9-13(12)17/h6-9H,4-5,10-11H2,1-3H3
InChIKeyRMSZLZLVPXGYGK-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.40
Rot. Bonds2

About N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide

N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide (PubChem CID 115641411) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
PubChem CID115641411
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
SMILESCCN(CC)C(=O)N1CCN(C)c2ccccc21
InChIInChI=1S/C14H21N3O/c1-4-16(5-2)14(18)17-11-10-15(3)12-8-6-7-9-13(12)17/h6-9H,4-5,10-11H2,1-3H3
InChIKeyRMSZLZLVPXGYGK-UHFFFAOYSA-N
XLogP2.40
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[ethyl-(4-methyl-2,3-dihydroquinoxaline-1-carbonyl)amino]acetic acid
CID 63778095
N,N-diethyl-2,3-dihydroindole-1-carboxamide
CID 2987329
2-bromo-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanone
CID 63778569
N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
CID 115683493
2-methyl-2-[methyl-(4-methyl-2,3-dihydroquinoxaline-1-carbonyl)amino]propanoic acid
CID 63776639
N,N-diethyl-3,4-dihydro-2H-1,5-benzoxazepine-5-carboxamide
CID 116657610
4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide
CID 110747567
N-ethyl-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)-3-oxopropanamide
CID 67472733
4-methyl-2,3-dihydroquinoxaline-1-carbohydrazide
CID 63776473
2-amino-2-methyl-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)propan-1-one
CID 55235571
4-hydroxy-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-one
CID 79192627
N-methyl-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)-3-oxopropanamide
CID 89467898

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The IUPAC name of N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide (CID 115641411) is N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide.
What is the SMILES notation for N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The canonical SMILES for N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide is CCN(CC)C(=O)N1CCN(C)c2ccccc21.
What is the InChIKey of N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The InChIKey is RMSZLZLVPXGYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-4-16(5-2)14(18)17-11-10-15(3)12-8-6-7-9-13(12)17/h6-9H,4-5,10-11H2,1-3H3.
What are the key properties of N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide is sourced from PubChem (CID 115641411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).