[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine

C12H18N4OS — CID 103336021

IUPAC[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCCc1cc2c(OC(C)(C)C)nc(NN)nc2s1
InChIInChI=1S/C12H18N4OS/c1-5-7-6-8-9(17-12(2,3)4)14-11(16-13)15-10(8)18-7/h6H,5,13H2,1-4H3,(H,14,15,16)
InChIKeyXULBVNIRVRHLIA-UHFFFAOYSA-N
MW266.37 g/mol
LogP2.72
Rot. Bonds3

About [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine

[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine (PubChem CID 103336021) has the molecular formula C12H18N4OS and a molecular weight of 266.37 g/mol. Its IUPAC name is [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
PubChem CID103336021
Molecular FormulaC12H18N4OS
Molecular Weight266.37 g/mol
Exact Mass266.12
IUPAC Name[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCCc1cc2c(OC(C)(C)C)nc(NN)nc2s1
InChIInChI=1S/C12H18N4OS/c1-5-7-6-8-9(17-12(2,3)4)14-11(16-13)15-10(8)18-7/h6H,5,13H2,1-4H3,(H,14,15,16)
InChIKeyXULBVNIRVRHLIA-UHFFFAOYSA-N
XLogP2.72
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

N,6-diethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335153
(4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine
CID 103336126
[6-ethyl-4-(2-methylpropoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336078
N-(2-ethoxy-2-methylpropyl)-6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335867
2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 103335072
[6-ethyl-4-(4-methylpentoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336025
6-ethyl-4-(2-methylbutan-2-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103331306
3-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]-2,2-difluoropropan-1-ol
CID 106179605
methyl 3-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]propanoate
CID 103332518
[6-ethyl-4-[(1-methyl-1,2,4-triazol-3-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 106598874
[6-ethyl-4-(3-iodophenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336225
[4-(3,4-dimethylpyrrolidin-1-yl)-6-ethylthieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103334491

Frequently Asked Questions

What is the IUPAC name of [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The IUPAC name of [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine (CID 103336021) is [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The canonical SMILES for [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine is CCc1cc2c(OC(C)(C)C)nc(NN)nc2s1.
What is the InChIKey of [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The InChIKey is XULBVNIRVRHLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4OS/c1-5-7-6-8-9(17-12(2,3)4)14-11(16-13)15-10(8)18-7/h6H,5,13H2,1-4H3,(H,14,15,16).
What are the key properties of [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine?
[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine has a molecular weight of 266.37 g/mol, XLogP of 2.72, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 103336021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).