(4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine

C12H18N4OS — CID 103336126

IUPAC(4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine
SMILESCCc1cc2c(OC(C)CC)nc(NN)nc2s1
InChIInChI=1S/C12H18N4OS/c1-4-7(3)17-10-9-6-8(5-2)18-11(9)15-12(14-10)16-13/h6-7H,4-5,13H2,1-3H3,(H,14,15,16)
InChIKeyWNCGPWOLIFMENT-UHFFFAOYSA-N
MW266.37 g/mol
LogP2.72
Rot. Bonds5

About (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine

(4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine (PubChem CID 103336126) has the molecular formula C12H18N4OS and a molecular weight of 266.37 g/mol. Its IUPAC name is (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine.

Molecular Properties

Compound Name(4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine
PubChem CID103336126
Molecular FormulaC12H18N4OS
Molecular Weight266.37 g/mol
Exact Mass266.12
IUPAC Name(4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine
SMILESCCc1cc2c(OC(C)CC)nc(NN)nc2s1
InChIInChI=1S/C12H18N4OS/c1-4-7(3)17-10-9-6-8(5-2)18-11(9)15-12(14-10)16-13/h6-7H,4-5,13H2,1-3H3,(H,14,15,16)
InChIKeyWNCGPWOLIFMENT-UHFFFAOYSA-N
XLogP2.72
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
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

[6-ethyl-4-(2-methylpropoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336078
[6-ethyl-4-(4-methylpentoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336025
[6-ethyl-4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336021
[4-(1-methoxypropan-2-yloxy)-6-methylthieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336311
[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
N,6-diethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335153
6-ethyl-2-hydrazinyl-N-methyl-N-(4-methylpentan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103333041
[6-ethyl-4-(3-methylcyclohexyl)oxythieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336034
ethyl 2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]propanoate
CID 103332795
6-ethyl-2-hydrazinyl-N,N-dipropylthieno[2,3-d]pyrimidin-4-amine
CID 103335029
2-N-(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 103335521

Frequently Asked Questions

What is the IUPAC name of (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine?
The IUPAC name of (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine (CID 103336126) is (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine.
What is the SMILES notation for (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine?
The canonical SMILES for (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine is CCc1cc2c(OC(C)CC)nc(NN)nc2s1.
What is the InChIKey of (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine?
The InChIKey is WNCGPWOLIFMENT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4OS/c1-4-7(3)17-10-9-6-8(5-2)18-11(9)15-12(14-10)16-13/h6-7H,4-5,13H2,1-3H3,(H,14,15,16).
What are the key properties of (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine?
(4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine has a molecular weight of 266.37 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4-butan-2-yloxy-6-ethylthieno[2,3-d]pyrimidin-2-yl)hydrazine is sourced from PubChem (CID 103336126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).