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

C12H17N3O — CID 115683493

IUPACN-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
SMILESCCNC(=O)N1CCN(C)c2ccccc21
InChIInChI=1S/C12H17N3O/c1-3-13-12(16)15-9-8-14(2)10-6-4-5-7-11(10)15/h4-7H,3,8-9H2,1-2H3,(H,13,16)
InChIKeyHUJDFRYCDMXZJA-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.67
Rot. Bonds1

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

N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide (PubChem CID 115683493) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
PubChem CID115683493
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC NameN-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
SMILESCCNC(=O)N1CCN(C)c2ccccc21
InChIInChI=1S/C12H17N3O/c1-3-13-12(16)15-9-8-14(2)10-6-4-5-7-11(10)15/h4-7H,3,8-9H2,1-2H3,(H,13,16)
InChIKeyHUJDFRYCDMXZJA-UHFFFAOYSA-N
XLogP1.67
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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-N-(2,2,2-trifluoroethyl)-2,3-dihydroquinoxaline-1-carboxamide
CID 116656087
4-methyl-2,3-dihydroquinoxaline-1-carbohydrazide
CID 63776473
2-hydroxy-3-[(4-methyl-2,3-dihydroquinoxaline-1-carbonyl)amino]propanoic acid
CID 66166560
2-bromo-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanone
CID 63778569
N,N-diethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
CID 115641411
N-methyl-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)-3-oxopropanamide
CID 89467898
2-(aminomethyl)-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)butan-1-one
CID 63779129
N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
CID 46382953
1-methyl-N-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,5-benzodiazepine-5-carboxamide
CID 91911956
2-amino-2-methyl-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)propan-1-one
CID 55235571

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The IUPAC name of N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide (CID 115683493) is N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide.
What is the SMILES notation for N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The canonical SMILES for N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide is CCNC(=O)N1CCN(C)c2ccccc21.
What is the InChIKey of N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The InChIKey is HUJDFRYCDMXZJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-3-13-12(16)15-9-8-14(2)10-6-4-5-7-11(10)15/h4-7H,3,8-9H2,1-2H3,(H,13,16).
What are the key properties of N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide is sourced from PubChem (CID 115683493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).