[4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine

C15H16N4OS — CID 103336205

IUPAC[4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCC(C)c1ccccc1Oc1nc(NN)nc2sccc12
InChIInChI=1S/C15H16N4OS/c1-9(2)10-5-3-4-6-12(10)20-13-11-7-8-21-14(11)18-15(17-13)19-16/h3-9H,16H2,1-2H3,(H,17,18,19)
InChIKeyRKOKRRNCRMQJTG-UHFFFAOYSA-N
MW300.39 g/mol
LogP3.89
Rot. Bonds4

About [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine

[4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine (PubChem CID 103336205) has the molecular formula C15H16N4OS and a molecular weight of 300.39 g/mol. Its IUPAC name is [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
PubChem CID103336205
Molecular FormulaC15H16N4OS
Molecular Weight300.39 g/mol
Exact Mass300.10
IUPAC Name[4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCC(C)c1ccccc1Oc1nc(NN)nc2sccc12
InChIInChI=1S/C15H16N4OS/c1-9(2)10-5-3-4-6-12(10)20-13-11-7-8-21-14(11)18-15(17-13)19-16/h3-9H,16H2,1-2H3,(H,17,18,19)
InChIKeyRKOKRRNCRMQJTG-UHFFFAOYSA-N
XLogP3.89
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.39
LogP ≤ 53.89
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

[4-(3-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336156
[4-(3-methylbutan-2-yloxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336370
[4-(4-methylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336141
[4-(2-fluoro-5-methylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336348
[4-(1,1,1-trifluoropropan-2-yloxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336356
[4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336022
[4-(4-bromo-3,5-dimethylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 107727417
[4-(3-bromophenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336191
(4-butoxythieno[2,3-d]pyrimidin-2-yl)hydrazine
CID 103336122
[4-(2-methoxyethoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336076
N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331842
N-ethyl-4-(2-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332005

Frequently Asked Questions

What is the IUPAC name of [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine (CID 103336205) is [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine is CC(C)c1ccccc1Oc1nc(NN)nc2sccc12.
What is the InChIKey of [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The InChIKey is RKOKRRNCRMQJTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4OS/c1-9(2)10-5-3-4-6-12(10)20-13-11-7-8-21-14(11)18-15(17-13)19-16/h3-9H,16H2,1-2H3,(H,17,18,19).
What are the key properties of [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
[4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine has a molecular weight of 300.39 g/mol, XLogP of 3.89, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 103336205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).