(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine

C13H12N4S — CID 735300

IUPAC(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine
SMILESCc1sc2ncnc(NN)c2c1-c1ccccc1
InChIInChI=1S/C13H12N4S/c1-8-10(9-5-3-2-4-6-9)11-12(17-14)15-7-16-13(11)18-8/h2-7H,14H2,1H3,(H,15,16,17)
InChIKeyVZTWYXFUQDVILY-UHFFFAOYSA-N
MW256.33 g/mol
LogP2.95
Rot. Bonds2

About (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine

(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine (PubChem CID 735300) has the molecular formula C13H12N4S and a molecular weight of 256.33 g/mol. Its IUPAC name is (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine
PubChem CID735300
Molecular FormulaC13H12N4S
Molecular Weight256.33 g/mol
Exact Mass256.08
IUPAC Name(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine
SMILESCc1sc2ncnc(NN)c2c1-c1ccccc1
InChIInChI=1S/C13H12N4S/c1-8-10(9-5-3-2-4-6-9)11-12(17-14)15-7-16-13(11)18-8/h2-7H,14H2,1H3,(H,15,16,17)
InChIKeyVZTWYXFUQDVILY-UHFFFAOYSA-N
XLogP2.95
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine?
The IUPAC name of (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine (CID 735300) is (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine is Cc1sc2ncnc(NN)c2c1-c1ccccc1.
What is the InChIKey of (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine?
The InChIKey is VZTWYXFUQDVILY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4S/c1-8-10(9-5-3-2-4-6-9)11-12(17-14)15-7-16-13(11)18-8/h2-7H,14H2,1H3,(H,15,16,17).
What are the key properties of (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine?
(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine has a molecular weight of 256.33 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine is sourced from PubChem (CID 735300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).