3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide

C20H22N4O — CID 46365128

IUPAC3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide
SMILESCCN(CC)c1nc2ccccc2nc1C(=O)Nc1ccccc1C
InChIInChI=1S/C20H22N4O/c1-4-24(5-2)19-18(21-16-12-8-9-13-17(16)22-19)20(25)23-15-11-7-6-10-14(15)3/h6-13H,4-5H2,1-3H3,(H,23,25)
InChIKeyBJZSXCASTPTERS-UHFFFAOYSA-N
MW334.42 g/mol
LogP4.04
Rot. Bonds5

About 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide

3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide (PubChem CID 46365128) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide.

Molecular Properties

Compound Name3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide
PubChem CID46365128
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide
SMILESCCN(CC)c1nc2ccccc2nc1C(=O)Nc1ccccc1C
InChIInChI=1S/C20H22N4O/c1-4-24(5-2)19-18(21-16-12-8-9-13-17(16)22-19)20(25)23-15-11-7-6-10-14(15)3/h6-13H,4-5H2,1-3H3,(H,23,25)
InChIKeyBJZSXCASTPTERS-UHFFFAOYSA-N
XLogP4.04
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[[3-(diethylamino)quinoxaline-2-carbonyl]amino]benzoate
CID 46365119
3-(diethylamino)-N-(3-fluoro-4-methylphenyl)quinoxaline-2-carboxamide
CID 46365100
N-(2,5-diethoxyphenyl)-3-(diethylamino)quinoxaline-2-carboxamide
CID 46365153
N-(3-chlorophenyl)-3-(diethylamino)quinoxaline-2-carboxamide
CID 46365134
2,5-dimethyl-N-(2-methylphenyl)-1,3-thiazole-4-carboxamide
CID 110465519
3-[3-(3-chloro-2-methylanilino)-2,3-dioxopropyl]-N-(2-methylphenyl)quinoxaline-2-carboxamide
CID 4181779
2-(diethylamino)-6-methyl-N-(2-methylphenyl)pyrimidine-4-carboxamide
CID 109332221
N-(2-methylphenyl)-1,3-benzothiazole-2-carboxamide
CID 2445261
4-amino-2-[ethyl(methyl)amino]-N-(2-methylphenyl)-1,3-thiazole-5-carboxamide
CID 116668996
3,6-dichloro-N-(2-methylphenyl)pyridine-2-carboxamide
CID 26914379
4-(dipropylsulfamoyl)-N-(2-methylphenyl)benzamide
CID 3936209
5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109190820

Frequently Asked Questions

What is the IUPAC name of 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide?
The IUPAC name of 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide (CID 46365128) is 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide.
What is the SMILES notation for 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide?
The canonical SMILES for 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide is CCN(CC)c1nc2ccccc2nc1C(=O)Nc1ccccc1C.
What is the InChIKey of 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide?
The InChIKey is BJZSXCASTPTERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-4-24(5-2)19-18(21-16-12-8-9-13-17(16)22-19)20(25)23-15-11-7-6-10-14(15)3/h6-13H,4-5H2,1-3H3,(H,23,25).
What are the key properties of 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide?
3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylamino)-N-(2-methylphenyl)quinoxaline-2-carboxamide is sourced from PubChem (CID 46365128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).