1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine

C15H15N3S — CID 105150148

IUPAC1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine
SMILESNC(CCc1cccs1)c1cccc2nccnc12
InChIInChI=1S/C15H15N3S/c16-13(7-6-11-3-2-10-19-11)12-4-1-5-14-15(12)18-9-8-17-14/h1-5,8-10,13H,6-7,16H2
InChIKeyUILHVAHSDGQFIU-UHFFFAOYSA-N
MW269.37 g/mol
LogP3.32
Rot. Bonds4

About 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine

1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine (PubChem CID 105150148) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine
PubChem CID105150148
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC Name1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine
SMILESNC(CCc1cccs1)c1cccc2nccnc12
InChIInChI=1S/C15H15N3S/c16-13(7-6-11-3-2-10-19-11)12-4-1-5-14-15(12)18-9-8-17-14/h1-5,8-10,13H,6-7,16H2
InChIKeyUILHVAHSDGQFIU-UHFFFAOYSA-N
XLogP3.32
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1-methylimidazol-2-yl)-1-quinoxalin-5-ylpropan-1-amine
CID 105187594
1-quinolin-8-yl-2-thiophen-2-ylethanamine
CID 81231172
2-(5-ethylthiophen-2-yl)-1-quinoxalin-5-ylethanamine
CID 105135907
1-(4-methyl-2-pyridinyl)-3-thiophen-2-ylpropan-1-amine
CID 63840233
(1-quinolin-4-yl-3-thiophen-2-ylpropyl)hydrazine
CID 105308809
2-(oxan-4-yl)-1-quinoxalin-5-ylethanamine
CID 105138578
1-(1,5-dimethylpyrazol-4-yl)-3-thiophen-2-ylpropan-1-amine
CID 105150310
1-pyrazolo[1,5-a]pyrazin-3-yl-3-thiophen-2-ylpropan-1-amine
CID 103127230
1-thieno[3,2-b]pyridin-6-yl-3-thiophen-2-ylpropan-1-amine
CID 81144341
1-(5-fluoro-2-pyridinyl)-3-thiophen-2-ylpropan-1-amine
CID 79722432
2-cyclohexyl-1-quinoxalin-5-ylethanamine
CID 105135471
2-(2-fluorophenyl)-1-quinoxalin-5-ylethanamine
CID 105090033

Frequently Asked Questions

What is the IUPAC name of 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine?
The IUPAC name of 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine (CID 105150148) is 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine?
The canonical SMILES for 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine is NC(CCc1cccs1)c1cccc2nccnc12.
What is the InChIKey of 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine?
The InChIKey is UILHVAHSDGQFIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c16-13(7-6-11-3-2-10-19-11)12-4-1-5-14-15(12)18-9-8-17-14/h1-5,8-10,13H,6-7,16H2.
What are the key properties of 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine?
1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine has a molecular weight of 269.37 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinoxalin-5-yl-3-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 105150148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).