[2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine

C14H14N4OS — CID 116777438

IUPAC[2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCOC(c1ccccc1)c1nc(NN)c2ccsc2n1
InChIInChI=1S/C14H14N4OS/c1-19-11(9-5-3-2-4-6-9)13-16-12(18-15)10-7-8-20-14(10)17-13/h2-8,11H,15H2,1H3,(H,16,17,18)
InChIKeyARASILXTXLSPFK-UHFFFAOYSA-N
MW286.36 g/mol
LogP2.71
Rot. Bonds4

About [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine

[2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 116777438) has the molecular formula C14H14N4OS and a molecular weight of 286.36 g/mol. Its IUPAC name is [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID116777438
Molecular FormulaC14H14N4OS
Molecular Weight286.36 g/mol
Exact Mass286.09
IUPAC Name[2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCOC(c1ccccc1)c1nc(NN)c2ccsc2n1
InChIInChI=1S/C14H14N4OS/c1-19-11(9-5-3-2-4-6-9)13-16-12(18-15)10-7-8-20-14(10)17-13/h2-8,11H,15H2,1H3,(H,16,17,18)
InChIKeyARASILXTXLSPFK-UHFFFAOYSA-N
XLogP2.71
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 52.71
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

2-hydrazinyl-N-(2-phenylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 103335640
[2-(2-methylpropyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62250650
[2-(3-methoxypentan-3-yl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 116777433
[2-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62502703
2-[methoxy(phenyl)methyl]-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 116777350
[2-(1-methoxy-4,4-dimethylcyclohexyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 116777447
2-(1-methoxy-2,2-dimethylpropyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 116728436
[2-(2-ethylbutoxymethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 114208585
2-(1-methoxybutyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 116728427
5-bromo-3-[methoxy(phenyl)methyl]-1,2,4-thiadiazole
CID 102618231
2-N-methyl-4-N-(1-phenylethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324196
[2-(1,1,1-trifluoropropan-2-yloxymethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 66274655

Frequently Asked Questions

What is the IUPAC name of [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine (CID 116777438) is [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine is COC(c1ccccc1)c1nc(NN)c2ccsc2n1.
What is the InChIKey of [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is ARASILXTXLSPFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4OS/c1-19-11(9-5-3-2-4-6-9)13-16-12(18-15)10-7-8-20-14(10)17-13/h2-8,11H,15H2,1H3,(H,16,17,18).
What are the key properties of [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
[2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 286.36 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methoxy(phenyl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 116777438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).