2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane

C20H26N4O2S — CID 143976397

IUPAC2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane
SMILESCC.Nc1nc(-c2ccc(C3CC3)o2)nc2sc(CN3CCOCC3)cc12
InChIInChI=1S/C18H20N4O2S.C2H6/c19-16-13-9-12(10-22-5-7-23-8-6-22)25-18(13)21-17(20-16)15-4-3-14(24-15)11-1-2-11;1-2/h3-4,9,11H,1-2,5-8,10H2,(H2,19,20,21);1-2H3
InChIKeyWLAGAVHANXHNFO-UHFFFAOYSA-N
MW386.52 g/mol
LogP4.27
Rot. Bonds4

About 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane

2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane (PubChem CID 143976397) has the molecular formula C20H26N4O2S and a molecular weight of 386.52 g/mol. Its IUPAC name is 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane.

Molecular Properties

Compound Name2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane
PubChem CID143976397
Molecular FormulaC20H26N4O2S
Molecular Weight386.52 g/mol
Exact Mass386.18
IUPAC Name2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane
SMILESCC.Nc1nc(-c2ccc(C3CC3)o2)nc2sc(CN3CCOCC3)cc12
InChIInChI=1S/C18H20N4O2S.C2H6/c19-16-13-9-12(10-22-5-7-23-8-6-22)25-18(13)21-17(20-16)15-4-3-14(24-15)11-1-2-11;1-2/h3-4,9,11H,1-2,5-8,10H2,(H2,19,20,21);1-2H3
InChIKeyWLAGAVHANXHNFO-UHFFFAOYSA-N
XLogP4.27
TPSA77.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.52
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane?
The IUPAC name of 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane (CID 143976397) is 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane.
What is the SMILES notation for 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane?
The canonical SMILES for 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane is CC.Nc1nc(-c2ccc(C3CC3)o2)nc2sc(CN3CCOCC3)cc12.
What is the InChIKey of 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane?
The InChIKey is WLAGAVHANXHNFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2S.C2H6/c19-16-13-9-12(10-22-5-7-23-8-6-22)25-18(13)21-17(20-16)15-4-3-14(24-15)11-1-2-11;1-2/h3-4,9,11H,1-2,5-8,10H2,(H2,19,20,21);1-2H3.
What are the key properties of 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane?
2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane has a molecular weight of 386.52 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane is sourced from PubChem (CID 143976397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).