(4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine

C9H8N4OS — CID 103336010

IUPAC(4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine
SMILESC#CCOc1nc(NN)nc2sccc12
InChIInChI=1S/C9H8N4OS/c1-2-4-14-7-6-3-5-15-8(6)12-9(11-7)13-10/h1,3,5H,4,10H2,(H,11,12,13)
InChIKeyRKYNHACFAQSCPS-UHFFFAOYSA-N
MW220.26 g/mol
LogP0.99
Rot. Bonds3

About (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine

(4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine (PubChem CID 103336010) has the molecular formula C9H8N4OS and a molecular weight of 220.26 g/mol. Its IUPAC name is (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine.

Molecular Properties

Compound Name(4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine
PubChem CID103336010
Molecular FormulaC9H8N4OS
Molecular Weight220.26 g/mol
Exact Mass220.04
IUPAC Name(4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine
SMILESC#CCOc1nc(NN)nc2sccc12
InChIInChI=1S/C9H8N4OS/c1-2-4-14-7-6-3-5-15-8(6)12-9(11-7)13-10/h1,3,5H,4,10H2,(H,11,12,13)
InChIKeyRKYNHACFAQSCPS-UHFFFAOYSA-N
XLogP0.99
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.26
LogP ≤ 50.99
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

N-methyl-4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-amine
CID 103331246
[4-(2-methoxyethoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336076
(4-butoxythieno[2,3-d]pyrimidin-2-yl)hydrazine
CID 103336122
2-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)oxy-N,N-dimethylethanamine
CID 103336249
[4-[(2-methylpropan-2-yl)oxy]thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336022
[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-(1,1,1-trifluoropropan-2-yloxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336356
3-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)oxybenzonitrile
CID 103336137
[4-(2-fluoro-5-methylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336348
[4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336205
[4-(4-bromo-3,5-dimethylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 107727417

Frequently Asked Questions

What is the IUPAC name of (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine?
The IUPAC name of (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine (CID 103336010) is (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine.
What is the SMILES notation for (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine?
The canonical SMILES for (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine is C#CCOc1nc(NN)nc2sccc12.
What is the InChIKey of (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine?
The InChIKey is RKYNHACFAQSCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4OS/c1-2-4-14-7-6-3-5-15-8(6)12-9(11-7)13-10/h1,3,5H,4,10H2,(H,11,12,13).
What are the key properties of (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine?
(4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine has a molecular weight of 220.26 g/mol, XLogP of 0.99, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-yl)hydrazine is sourced from PubChem (CID 103336010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).