3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine

C16H16N4S — CID 102985686

IUPAC3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine
SMILESCC1c2ccsc2CCN1c1nc2ccccc2nc1N
InChIInChI=1S/C16H16N4S/c1-10-11-7-9-21-14(11)6-8-20(10)16-15(17)18-12-4-2-3-5-13(12)19-16/h2-5,7,9-10H,6,8H2,1H3,(H2,17,18)
InChIKeyFUZRFOYDBYGIML-UHFFFAOYSA-N
MW296.40 g/mol
LogP3.40
Rot. Bonds1

About 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine

3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine (PubChem CID 102985686) has the molecular formula C16H16N4S and a molecular weight of 296.40 g/mol. Its IUPAC name is 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine.

Molecular Properties

Compound Name3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine
PubChem CID102985686
Molecular FormulaC16H16N4S
Molecular Weight296.40 g/mol
Exact Mass296.11
IUPAC Name3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine
SMILESCC1c2ccsc2CCN1c1nc2ccccc2nc1N
InChIInChI=1S/C16H16N4S/c1-10-11-7-9-21-14(11)6-8-20(10)16-15(17)18-12-4-2-3-5-13(12)19-16/h2-5,7,9-10H,6,8H2,1H3,(H2,17,18)
InChIKeyFUZRFOYDBYGIML-UHFFFAOYSA-N
XLogP3.40
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.40
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrimidin-2-amine
CID 80815106
5-(2,5-dichloropyrimidin-4-yl)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 79633122
4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine
CID 55011051
4-chloro-2-methyl-6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrimidine-5-carbaldehyde
CID 80732572
5-(2-chloro-5-fluoropyrimidin-4-yl)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 79081457
[8-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80902444
N-ethyl-5-methyl-4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrimidin-2-amine
CID 80815193
N'-hydroxy-6-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridine-3-carboximidamide
CID 76916212
2-cyclopropyl-6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrimidin-4-amine
CID 80961425
5-(6-chloro-5-methylpyrimidin-4-yl)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 63729494
2-[(4R)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-5-nitropyrimidin-4-amine
CID 97189194
4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80788902

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine?
The IUPAC name of 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine (CID 102985686) is 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine.
What is the SMILES notation for 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine?
The canonical SMILES for 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine is CC1c2ccsc2CCN1c1nc2ccccc2nc1N.
What is the InChIKey of 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine?
The InChIKey is FUZRFOYDBYGIML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4S/c1-10-11-7-9-21-14(11)6-8-20(10)16-15(17)18-12-4-2-3-5-13(12)19-16/h2-5,7,9-10H,6,8H2,1H3,(H2,17,18).
What are the key properties of 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine?
3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine has a molecular weight of 296.40 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine is sourced from PubChem (CID 102985686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).