[2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine

C10H11ClN4S — CID 105221137

IUPAC[2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)s1)c1ccncn1
InChIInChI=1S/C10H11ClN4S/c11-10-2-1-7(16-10)5-9(15-12)8-3-4-13-6-14-8/h1-4,6,9,15H,5,12H2
InChIKeyMFDISJLFSKKDHZ-UHFFFAOYSA-N
MW254.75 g/mol
LogP1.94
Rot. Bonds4

About [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine

[2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine (PubChem CID 105221137) has the molecular formula C10H11ClN4S and a molecular weight of 254.75 g/mol. Its IUPAC name is [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine
PubChem CID105221137
Molecular FormulaC10H11ClN4S
Molecular Weight254.75 g/mol
Exact Mass254.04
IUPAC Name[2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)s1)c1ccncn1
InChIInChI=1S/C10H11ClN4S/c11-10-2-1-7(16-10)5-9(15-12)8-3-4-13-6-14-8/h1-4,6,9,15H,5,12H2
InChIKeyMFDISJLFSKKDHZ-UHFFFAOYSA-N
XLogP1.94
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.75
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine?
The IUPAC name of [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine (CID 105221137) is [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine.
What is the SMILES notation for [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine?
The canonical SMILES for [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine is NNC(Cc1ccc(Cl)s1)c1ccncn1.
What is the InChIKey of [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine?
The InChIKey is MFDISJLFSKKDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4S/c11-10-2-1-7(16-10)5-9(15-12)8-3-4-13-6-14-8/h1-4,6,9,15H,5,12H2.
What are the key properties of [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine?
[2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine has a molecular weight of 254.75 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-chlorothiophen-2-yl)-1-pyrimidin-4-ylethyl]hydrazine is sourced from PubChem (CID 105221137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).