N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide

C20H20N4O2 — CID 39886365

IUPACN-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide
SMILESCc1ccc(NC(=O)c2nc3ccccc3nc2N2CCOCC2)cc1
InChIInChI=1S/C20H20N4O2/c1-14-6-8-15(9-7-14)21-20(25)18-19(24-10-12-26-13-11-24)23-17-5-3-2-4-16(17)22-18/h2-9H,10-13H2,1H3,(H,21,25)
InChIKeyONSPZEIFMASFNH-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.03
Rot. Bonds3

About N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide

N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide (PubChem CID 39886365) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide
PubChem CID39886365
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC NameN-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide
SMILESCc1ccc(NC(=O)c2nc3ccccc3nc2N2CCOCC2)cc1
InChIInChI=1S/C20H20N4O2/c1-14-6-8-15(9-7-14)21-20(25)18-19(24-10-12-26-13-11-24)23-17-5-3-2-4-16(17)22-18/h2-9H,10-13H2,1H3,(H,21,25)
InChIKeyONSPZEIFMASFNH-UHFFFAOYSA-N
XLogP3.03
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethoxyphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide
CID 39886408
N-(2-chloro-4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide
CID 39886350
N-(3-chloro-4-morpholin-4-ylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide
CID 46249483
N-(4-acetylphenyl)-3-pyrrolidin-1-ylquinoxaline-2-carboxamide
CID 53094663
N-(4-methylphenyl)-2-morpholin-4-ylquinoline-4-carboxamide
CID 659672
N-(2,4-dimethoxyphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide
CID 46365271
N-(4-methylphenyl)-4-morpholin-4-yl-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxamide
CID 20948791
N-(4-methylphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
CID 84573865
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-piperidin-1-ylquinoxaline-2-carboxamide
CID 46365174
N-(2,6-dimethylphenyl)-3-(4-methylpiperazin-1-yl)quinoxaline-2-carboxamide
CID 46365230
3-methyl-N-(4-pyrrolidin-1-ylphenyl)quinoxaline-2-carboxamide
CID 110862119
N-(4-methylphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
CID 2910267

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide?
The IUPAC name of N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide (CID 39886365) is N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide.
What is the SMILES notation for N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide?
The canonical SMILES for N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide is Cc1ccc(NC(=O)c2nc3ccccc3nc2N2CCOCC2)cc1.
What is the InChIKey of N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide?
The InChIKey is ONSPZEIFMASFNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-14-6-8-15(9-7-14)21-20(25)18-19(24-10-12-26-13-11-24)23-17-5-3-2-4-16(17)22-18/h2-9H,10-13H2,1H3,(H,21,25).
What are the key properties of N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide?
N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-3-morpholin-4-ylquinoxaline-2-carboxamide is sourced from PubChem (CID 39886365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).