N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine

C17H19N3O — CID 107357381

IUPACN-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccco1)c1cnc2ccccc2n1
InChIInChI=1S/C17H19N3O/c1-2-9-18-16(11-13-6-5-10-21-13)17-12-19-14-7-3-4-8-15(14)20-17/h3-8,10,12,16,18H,2,9,11H2,1H3
InChIKeyAURHPVFODYWWAC-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.51
Rot. Bonds6

About N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine

N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine (PubChem CID 107357381) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine
PubChem CID107357381
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccco1)c1cnc2ccccc2n1
InChIInChI=1S/C17H19N3O/c1-2-9-18-16(11-13-6-5-10-21-13)17-12-19-14-7-3-4-8-15(14)20-17/h3-8,10,12,16,18H,2,9,11H2,1H3
InChIKeyAURHPVFODYWWAC-UHFFFAOYSA-N
XLogP3.51
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-propyl-1-quinoxalin-2-ylbut-3-en-1-amine
CID 107357266
N-[(3-bromofuran-2-yl)-quinoxalin-2-ylmethyl]propan-1-amine
CID 107357164
N-[2-(furan-2-yl)-1-(1-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 83174760
N-[2-(furan-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
CID 83183572
N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine
CID 83175594
N-[pyrimidin-5-yl(quinoxalin-2-yl)methyl]propan-1-amine
CID 107356998
N-[2-(furan-2-yl)-1-(3-methyl-4-pyridinyl)ethyl]propan-1-amine
CID 83182976
N-[1-(4-bromophenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 83176193
N-[1-(5-ethylfuran-2-yl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 105029341
N-[2-(furan-2-yl)-1-[4-(trifluoromethyl)phenyl]ethyl]propan-1-amine
CID 105029239
N-methyl-2-phenyl-1-quinoxalin-2-ylethanamine
CID 107356897
N-[1-(3-chloro-2-methylphenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 107103017

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine?
The IUPAC name of N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine (CID 107357381) is N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine.
What is the SMILES notation for N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine?
The canonical SMILES for N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine is CCCNC(Cc1ccco1)c1cnc2ccccc2n1.
What is the InChIKey of N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine?
The InChIKey is AURHPVFODYWWAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-2-9-18-16(11-13-6-5-10-21-13)17-12-19-14-7-3-4-8-15(14)20-17/h3-8,10,12,16,18H,2,9,11H2,1H3.
What are the key properties of N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine?
N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine has a molecular weight of 281.36 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine is sourced from PubChem (CID 107357381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).