[6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine

C13H12Cl2N4 — CID 55191217

IUPAC[6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine
SMILESNNc1cc(C2CC2)nc(-c2c(Cl)cccc2Cl)n1
InChIInChI=1S/C13H12Cl2N4/c14-8-2-1-3-9(15)12(8)13-17-10(7-4-5-7)6-11(18-13)19-16/h1-3,6-7H,4-5,16H2,(H,17,18,19)
InChIKeyFFPVJWHIHRVSCY-UHFFFAOYSA-N
MW295.17 g/mol
LogP3.61
Rot. Bonds3

About [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine

[6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine (PubChem CID 55191217) has the molecular formula C13H12Cl2N4 and a molecular weight of 295.17 g/mol. Its IUPAC name is [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine
PubChem CID55191217
Molecular FormulaC13H12Cl2N4
Molecular Weight295.17 g/mol
Exact Mass294.04
IUPAC Name[6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine
SMILESNNc1cc(C2CC2)nc(-c2c(Cl)cccc2Cl)n1
InChIInChI=1S/C13H12Cl2N4/c14-8-2-1-3-9(15)12(8)13-17-10(7-4-5-7)6-11(18-13)19-16/h1-3,6-7H,4-5,16H2,(H,17,18,19)
InChIKeyFFPVJWHIHRVSCY-UHFFFAOYSA-N
XLogP3.61
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 53.61
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 [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine (CID 55191217) is [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine is NNc1cc(C2CC2)nc(-c2c(Cl)cccc2Cl)n1.
What is the InChIKey of [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine?
The InChIKey is FFPVJWHIHRVSCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2N4/c14-8-2-1-3-9(15)12(8)13-17-10(7-4-5-7)6-11(18-13)19-16/h1-3,6-7H,4-5,16H2,(H,17,18,19).
What are the key properties of [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine?
[6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine has a molecular weight of 295.17 g/mol, XLogP of 3.61, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 55191217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).