2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine

C20H24N4O2S — CID 133278714

IUPAC2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine
SMILESCOCc1nc(NCCN2CCOCC2)c2c(-c3ccccc3)csc2n1
InChIInChI=1S/C20H24N4O2S/c1-25-13-17-22-19(21-7-8-24-9-11-26-12-10-24)18-16(14-27-20(18)23-17)15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H,21,22,23)
InChIKeyVMKNPOYFRDPLPW-UHFFFAOYSA-N
MW384.51 g/mol
LogP3.25
Rot. Bonds7

About 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine

2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 133278714) has the molecular formula C20H24N4O2S and a molecular weight of 384.51 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine
PubChem CID133278714
Molecular FormulaC20H24N4O2S
Molecular Weight384.51 g/mol
Exact Mass384.16
IUPAC Name2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine
SMILESCOCc1nc(NCCN2CCOCC2)c2c(-c3ccccc3)csc2n1
InChIInChI=1S/C20H24N4O2S/c1-25-13-17-22-19(21-7-8-24-9-11-26-12-10-24)18-16(14-27-20(18)23-17)15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H,21,22,23)
InChIKeyVMKNPOYFRDPLPW-UHFFFAOYSA-N
XLogP3.25
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.51
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine 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-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine (CID 133278714) is 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine is COCc1nc(NCCN2CCOCC2)c2c(-c3ccccc3)csc2n1.
What is the InChIKey of 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is VMKNPOYFRDPLPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2S/c1-25-13-17-22-19(21-7-8-24-9-11-26-12-10-24)18-16(14-27-20(18)23-17)15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H,21,22,23).
What are the key properties of 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine?
2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 384.51 g/mol, XLogP of 3.25, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-(2-morpholin-4-ylethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 133278714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).