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

C13H19N3O — CID 110747567

IUPAC4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide
SMILESCCCNC(=O)N1CCN(C)c2ccccc21
InChIInChI=1S/C13H19N3O/c1-3-8-14-13(17)16-10-9-15(2)11-6-4-5-7-12(11)16/h4-7H,3,8-10H2,1-2H3,(H,14,17)
InChIKeyBCNSWQFWSPLSGP-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.06
Rot. Bonds2

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

4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide (PubChem CID 110747567) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide
PubChem CID110747567
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide
SMILESCCCNC(=O)N1CCN(C)c2ccccc21
InChIInChI=1S/C13H19N3O/c1-3-8-14-13(17)16-10-9-15(2)11-6-4-5-7-12(11)16/h4-7H,3,8-10H2,1-2H3,(H,14,17)
InChIKeyBCNSWQFWSPLSGP-UHFFFAOYSA-N
XLogP2.06
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
CID 115683493
4-propan-2-yl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide
CID 110669824
4-[2-(dimethylamino)ethyl]-N-propyl-2,3-dihydroquinoxaline-1-carboxamide
CID 110358714
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
N-ethyl-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)-3-oxopropanamide
CID 67472733
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

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide?
The IUPAC name of 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide (CID 110747567) is 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide.
What is the SMILES notation for 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide?
The canonical SMILES for 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide is CCCNC(=O)N1CCN(C)c2ccccc21.
What is the InChIKey of 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide?
The InChIKey is BCNSWQFWSPLSGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-3-8-14-13(17)16-10-9-15(2)11-6-4-5-7-12(11)16/h4-7H,3,8-10H2,1-2H3,(H,14,17).
What are the key properties of 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide?
4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propyl-2,3-dihydroquinoxaline-1-carboxamide is sourced from PubChem (CID 110747567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).