2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine

C14H16N4OS2 — CID 143535514

IUPAC2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine
SMILESCOCc1csc2nc(-c3cccs3)nc(NN(C)C)c12
InChIInChI=1S/C14H16N4OS2/c1-18(2)17-13-11-9(7-19-3)8-21-14(11)16-12(15-13)10-5-4-6-20-10/h4-6,8H,7H2,1-3H3,(H,15,16,17)
InChIKeyLJWNXZFBURQJJL-UHFFFAOYSA-N
MW320.44 g/mol
LogP3.45
Rot. Bonds5

About 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine

2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine (PubChem CID 143535514) has the molecular formula C14H16N4OS2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine
PubChem CID143535514
Molecular FormulaC14H16N4OS2
Molecular Weight320.44 g/mol
Exact Mass320.08
IUPAC Name2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine
SMILESCOCc1csc2nc(-c3cccs3)nc(NN(C)C)c12
InChIInChI=1S/C14H16N4OS2/c1-18(2)17-13-11-9(7-19-3)8-21-14(11)16-12(15-13)10-5-4-6-20-10/h4-6,8H,7H2,1-3H3,(H,15,16,17)
InChIKeyLJWNXZFBURQJJL-UHFFFAOYSA-N
XLogP3.45
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine?
The IUPAC name of 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine (CID 143535514) is 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine.
What is the SMILES notation for 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine?
The canonical SMILES for 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine is COCc1csc2nc(-c3cccs3)nc(NN(C)C)c12.
What is the InChIKey of 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine?
The InChIKey is LJWNXZFBURQJJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS2/c1-18(2)17-13-11-9(7-19-3)8-21-14(11)16-12(15-13)10-5-4-6-20-10/h4-6,8H,7H2,1-3H3,(H,15,16,17).
What are the key properties of 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine?
2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine has a molecular weight of 320.44 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(methoxymethyl)-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]-1,1-dimethylhydrazine is sourced from PubChem (CID 143535514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).