6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine

C14H18N4S — CID 80764105

IUPAC6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine
SMILESCCc1c(NC)ncnc1N1CCc2sccc2C1
InChIInChI=1S/C14H18N4S/c1-3-11-13(15-2)16-9-17-14(11)18-6-4-12-10(8-18)5-7-19-12/h5,7,9H,3-4,6,8H2,1-2H3,(H,15,16,17)
InChIKeyMHLWXDGOGCOWAM-UHFFFAOYSA-N
MW274.39 g/mol
LogP2.70
Rot. Bonds3

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

6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine (PubChem CID 80764105) has the molecular formula C14H18N4S and a molecular weight of 274.39 g/mol. Its IUPAC name is 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine
PubChem CID80764105
Molecular FormulaC14H18N4S
Molecular Weight274.39 g/mol
Exact Mass274.13
IUPAC Name6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine
SMILESCCc1c(NC)ncnc1N1CCc2sccc2C1
InChIInChI=1S/C14H18N4S/c1-3-11-13(15-2)16-9-17-14(11)18-6-4-12-10(8-18)5-7-19-12/h5,7,9H,3-4,6,8H2,1-2H3,(H,15,16,17)
InChIKeyMHLWXDGOGCOWAM-UHFFFAOYSA-N
XLogP2.70
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine?
The IUPAC name of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine (CID 80764105) is 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine is CCc1c(NC)ncnc1N1CCc2sccc2C1.
What is the InChIKey of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine?
The InChIKey is MHLWXDGOGCOWAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4S/c1-3-11-13(15-2)16-9-17-14(11)18-6-4-12-10(8-18)5-7-19-12/h5,7,9H,3-4,6,8H2,1-2H3,(H,15,16,17).
What are the key properties of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine?
6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine has a molecular weight of 274.39 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine is sourced from PubChem (CID 80764105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).