N-(1-thiophen-2-ylethyl)quinoxalin-2-amine

C14H13N3S — CID 47142874

IUPACN-(1-thiophen-2-ylethyl)quinoxalin-2-amine
SMILESCC(Nc1cnc2ccccc2n1)c1cccs1
InChIInChI=1S/C14H13N3S/c1-10(13-7-4-8-18-13)16-14-9-15-11-5-2-3-6-12(11)17-14/h2-10H,1H3,(H,16,17)
InChIKeyGAHSOFNJVYTUIR-UHFFFAOYSA-N
MW255.35 g/mol
LogP3.86
Rot. Bonds3

About N-(1-thiophen-2-ylethyl)quinoxalin-2-amine

N-(1-thiophen-2-ylethyl)quinoxalin-2-amine (PubChem CID 47142874) has the molecular formula C14H13N3S and a molecular weight of 255.35 g/mol. Its IUPAC name is N-(1-thiophen-2-ylethyl)quinoxalin-2-amine.

Molecular Properties

Compound NameN-(1-thiophen-2-ylethyl)quinoxalin-2-amine
PubChem CID47142874
Molecular FormulaC14H13N3S
Molecular Weight255.35 g/mol
Exact Mass255.08
IUPAC NameN-(1-thiophen-2-ylethyl)quinoxalin-2-amine
SMILESCC(Nc1cnc2ccccc2n1)c1cccs1
InChIInChI=1S/C14H13N3S/c1-10(13-7-4-8-18-13)16-14-9-15-11-5-2-3-6-12(11)17-14/h2-10H,1H3,(H,16,17)
InChIKeyGAHSOFNJVYTUIR-UHFFFAOYSA-N
XLogP3.86
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.35
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1R)-1-(1,3-thiazol-5-yl)ethyl]quinoxalin-2-amine
CID 166378482
N-[1-(5-methylthiophen-2-yl)ethyl]quinoxalin-2-amine
CID 47371005
N-(1-pyridin-4-ylethyl)quinoxalin-2-amine
CID 55024904
N-[1-(4-chlorophenyl)ethyl]quinoxalin-2-amine
CID 60716470
N-[(1S)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]quinoxalin-2-amine
CID 164640206
6-bromo-N-(1-thiophen-2-ylethyl)pyridin-2-amine
CID 63961100
2-methyl-N-(quinoxalin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
CID 43786598
N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
CID 43397770
N-(2-methyl-2-thiophen-2-ylpropyl)quinoxalin-2-amine
CID 78962959
2-ethyl-6-N-methyl-4-N-(1-thiophen-2-ylethyl)pyrimidine-4,6-diamine
CID 80933955
N-tert-butyl-2-(quinoxalin-2-ylamino)propanamide
CID 115596829
N-(4-phenylbutan-2-yl)quinoxalin-2-amine
CID 60716412

Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylethyl)quinoxalin-2-amine?
The IUPAC name of N-(1-thiophen-2-ylethyl)quinoxalin-2-amine (CID 47142874) is N-(1-thiophen-2-ylethyl)quinoxalin-2-amine.
What is the SMILES notation for N-(1-thiophen-2-ylethyl)quinoxalin-2-amine?
The canonical SMILES for N-(1-thiophen-2-ylethyl)quinoxalin-2-amine is CC(Nc1cnc2ccccc2n1)c1cccs1.
What is the InChIKey of N-(1-thiophen-2-ylethyl)quinoxalin-2-amine?
The InChIKey is GAHSOFNJVYTUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3S/c1-10(13-7-4-8-18-13)16-14-9-15-11-5-2-3-6-12(11)17-14/h2-10H,1H3,(H,16,17).
What are the key properties of N-(1-thiophen-2-ylethyl)quinoxalin-2-amine?
N-(1-thiophen-2-ylethyl)quinoxalin-2-amine has a molecular weight of 255.35 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-2-ylethyl)quinoxalin-2-amine is sourced from PubChem (CID 47142874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).