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

C13H19N5OS — CID 62245346

IUPAC[2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCC1(C)COCCN1Cc1nc(NN)c2ccsc2n1
InChIInChI=1S/C13H19N5OS/c1-13(2)8-19-5-4-18(13)7-10-15-11(17-14)9-3-6-20-12(9)16-10/h3,6H,4-5,7-8,14H2,1-2H3,(H,15,16,17)
InChIKeyRHYZTZBNSWTDEH-UHFFFAOYSA-N
MW293.40 g/mol
LogP1.59
Rot. Bonds3

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

[2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 62245346) has the molecular formula C13H19N5OS and a molecular weight of 293.40 g/mol. Its IUPAC name is [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID62245346
Molecular FormulaC13H19N5OS
Molecular Weight293.40 g/mol
Exact Mass293.13
IUPAC Name[2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESCC1(C)COCCN1Cc1nc(NN)c2ccsc2n1
InChIInChI=1S/C13H19N5OS/c1-13(2)8-19-5-4-18(13)7-10-15-11(17-14)9-3-6-20-12(9)16-10/h3,6H,4-5,7-8,14H2,1-2H3,(H,15,16,17)
InChIKeyRHYZTZBNSWTDEH-UHFFFAOYSA-N
XLogP1.59
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.40
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine (CID 62245346) is [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine is CC1(C)COCCN1Cc1nc(NN)c2ccsc2n1.
What is the InChIKey of [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is RHYZTZBNSWTDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5OS/c1-13(2)8-19-5-4-18(13)7-10-15-11(17-14)9-3-6-20-12(9)16-10/h3,6H,4-5,7-8,14H2,1-2H3,(H,15,16,17).
What are the key properties of [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine?
[2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 293.40 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3,3-dimethylmorpholin-4-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62245346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).