[2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine

C14H18N6S — CID 82699155

IUPAC[2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCCc1cc(CC)n(Cc2nc(NN)c3ccsc3n2)n1
InChIInChI=1S/C14H18N6S/c1-3-9-7-10(4-2)20(19-9)8-12-16-13(18-15)11-5-6-21-14(11)17-12/h5-7H,3-4,8,15H2,1-2H3,(H,16,17,18)
InChIKeyJGCKAWVIYXAXGY-UHFFFAOYSA-N
MW302.41 g/mol
LogP2.35
Rot. Bonds5

About [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine

[2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 82699155) has the molecular formula C14H18N6S and a molecular weight of 302.41 g/mol. Its IUPAC name is [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID82699155
Molecular FormulaC14H18N6S
Molecular Weight302.41 g/mol
Exact Mass302.13
IUPAC Name[2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCCc1cc(CC)n(Cc2nc(NN)c3ccsc3n2)n1
InChIInChI=1S/C14H18N6S/c1-3-9-7-10(4-2)20(19-9)8-12-16-13(18-15)11-5-6-21-14(11)17-12/h5-7H,3-4,8,15H2,1-2H3,(H,16,17,18)
InChIKeyJGCKAWVIYXAXGY-UHFFFAOYSA-N
XLogP2.35
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.41
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

[2-(imidazol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62244451
1-[(4-hydrazinylthieno[2,3-d]pyrimidin-2-yl)methyl]pyrrolidine-2,5-dione
CID 62245015
[2-(2-methylpropyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62250650
[2-[(3,5-dimethylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62244605
N-ethyl-2,2,2-trifluoro-N-[(4-hydrazinylthieno[2,3-d]pyrimidin-2-yl)methyl]ethanamine
CID 62245884
1-[(4-hydrazinylthieno[2,3-d]pyrimidin-2-yl)methyl]-4-propan-2-ylpyrrolidin-2-one
CID 104512790
[2-[(4,4-dimethylazepan-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 65281811
[2-[(3,4-dimethylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 63635107
[2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62245346
[2-(2-ethylbutoxymethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 114208585
[2-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62502703
[2-(3,3,3-trifluoropropyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 79965201

Frequently Asked Questions

What is the IUPAC name of [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine (CID 82699155) is [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine is CCc1cc(CC)n(Cc2nc(NN)c3ccsc3n2)n1.
What is the InChIKey of [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is JGCKAWVIYXAXGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6S/c1-3-9-7-10(4-2)20(19-9)8-12-16-13(18-15)11-5-6-21-14(11)17-12/h5-7H,3-4,8,15H2,1-2H3,(H,16,17,18).
What are the key properties of [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
[2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 302.41 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3,5-diethylpyrazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 82699155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).