(2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine

C11H19N5S — CID 13393618

IUPAC(2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine
SMILESCCCc1nc(NN)cc(N2CCSCC2)n1
InChIInChI=1S/C11H19N5S/c1-2-3-9-13-10(15-12)8-11(14-9)16-4-6-17-7-5-16/h8H,2-7,12H2,1H3,(H,13,14,15)
InChIKeyTZWMSUQRVYRTMJ-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.27
Rot. Bonds4

About (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine

(2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine (PubChem CID 13393618) has the molecular formula C11H19N5S and a molecular weight of 253.37 g/mol. Its IUPAC name is (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine
PubChem CID13393618
Molecular FormulaC11H19N5S
Molecular Weight253.37 g/mol
Exact Mass253.14
IUPAC Name(2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine
SMILESCCCc1nc(NN)cc(N2CCSCC2)n1
InChIInChI=1S/C11H19N5S/c1-2-3-9-13-10(15-12)8-11(14-9)16-4-6-17-7-5-16/h8H,2-7,12H2,1H3,(H,13,14,15)
InChIKeyTZWMSUQRVYRTMJ-UHFFFAOYSA-N
XLogP1.27
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 51.27
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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Frequently Asked Questions

What is the IUPAC name of (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine?
The IUPAC name of (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine (CID 13393618) is (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine is CCCc1nc(NN)cc(N2CCSCC2)n1.
What is the InChIKey of (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine?
The InChIKey is TZWMSUQRVYRTMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5S/c1-2-3-9-13-10(15-12)8-11(14-9)16-4-6-17-7-5-16/h8H,2-7,12H2,1H3,(H,13,14,15).
What are the key properties of (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine?
(2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine has a molecular weight of 253.37 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propyl-6-thiomorpholin-4-ylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 13393618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).