[2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine

C12H12Cl2N4 — CID 105220906

IUPAC[2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine
SMILESNNC(Cc1c(Cl)cccc1Cl)c1ccncn1
InChIInChI=1S/C12H12Cl2N4/c13-9-2-1-3-10(14)8(9)6-12(18-15)11-4-5-16-7-17-11/h1-5,7,12,18H,6,15H2
InChIKeyJRZNPSPIJIOGLT-UHFFFAOYSA-N
MW283.16 g/mol
LogP2.53
Rot. Bonds4

About [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine

[2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine (PubChem CID 105220906) has the molecular formula C12H12Cl2N4 and a molecular weight of 283.16 g/mol. Its IUPAC name is [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine
PubChem CID105220906
Molecular FormulaC12H12Cl2N4
Molecular Weight283.16 g/mol
Exact Mass282.04
IUPAC Name[2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine
SMILESNNC(Cc1c(Cl)cccc1Cl)c1ccncn1
InChIInChI=1S/C12H12Cl2N4/c13-9-2-1-3-10(14)8(9)6-12(18-15)11-4-5-16-7-17-11/h1-5,7,12,18H,6,15H2
InChIKeyJRZNPSPIJIOGLT-UHFFFAOYSA-N
XLogP2.53
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.16
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine?
The IUPAC name of [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine (CID 105220906) is [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine.
What is the SMILES notation for [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine?
The canonical SMILES for [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine is NNC(Cc1c(Cl)cccc1Cl)c1ccncn1.
What is the InChIKey of [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine?
The InChIKey is JRZNPSPIJIOGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12Cl2N4/c13-9-2-1-3-10(14)8(9)6-12(18-15)11-4-5-16-7-17-11/h1-5,7,12,18H,6,15H2.
What are the key properties of [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine?
[2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine has a molecular weight of 283.16 g/mol, XLogP of 2.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-dichlorophenyl)-1-pyrimidin-4-ylethyl]hydrazine is sourced from PubChem (CID 105220906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).