N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide

C16H15N3O2 — CID 46443465

IUPACN-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2cnc3ccccc3n2)o1
InChIInChI=1S/C16H15N3O2/c1-10-7-8-15(21-10)11(2)18-16(20)14-9-17-12-5-3-4-6-13(12)19-14/h3-9,11H,1-2H3,(H,18,20)
InChIKeyZZGDSZRCEWJFSY-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.02
Rot. Bonds3

About N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide

N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide (PubChem CID 46443465) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide
PubChem CID46443465
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC NameN-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2cnc3ccccc3n2)o1
InChIInChI=1S/C16H15N3O2/c1-10-7-8-15(21-10)11(2)18-16(20)14-9-17-12-5-3-4-6-13(12)19-14/h3-9,11H,1-2H3,(H,18,20)
InChIKeyZZGDSZRCEWJFSY-UHFFFAOYSA-N
XLogP3.02
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(5-methylfuran-2-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 63049931
N-[(2S)-1-aminopropan-2-yl]quinoxaline-2-carboxamide
CID 120507243
5-methyl-N-[(1R)-1-(5-methylfuran-2-yl)ethyl]-1,2-oxazole-3-carboxamide
CID 94177083
N-[1-(3,4-difluorophenyl)ethyl]quinoxaline-2-carboxamide
CID 134013463
N-[1-(4,5-dimethoxy-2-methylphenyl)ethyl]quinoxaline-2-carboxamide
CID 46474012
N-(4-hydroxy-3-methylbutan-2-yl)quinoxaline-2-carboxamide
CID 115734850
N-[1-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]quinoxaline-2-carboxamide
CID 91786383
5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
CID 63722692
N-(1-hydroxy-4-methylpentan-2-yl)quinoxaline-2-carboxamide
CID 61246505
N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]quinoxaline-2-carboxamide
CID 41082957
N-(2-methylpropyl)quinoxaline-2-carboxamide
CID 32978197
4-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 47209094

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide?
The IUPAC name of N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide (CID 46443465) is N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide.
What is the SMILES notation for N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide?
The canonical SMILES for N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide is Cc1ccc(C(C)NC(=O)c2cnc3ccccc3n2)o1.
What is the InChIKey of N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide?
The InChIKey is ZZGDSZRCEWJFSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-10-7-8-15(21-10)11(2)18-16(20)14-9-17-12-5-3-4-6-13(12)19-14/h3-9,11H,1-2H3,(H,18,20).
What are the key properties of N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide?
N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide is sourced from PubChem (CID 46443465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).