(2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine

C4H3Cl2FN4 — CID 86637037

IUPAC(2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine
SMILESNNc1nc(Cl)nc(Cl)c1F
InChIInChI=1S/C4H3Cl2FN4/c5-2-1(7)3(11-8)10-4(6)9-2/h8H2,(H,9,10,11)
InChIKeyPGFAXTWMSLDHDZ-UHFFFAOYSA-N
MW197.00 g/mol
LogP1.21
Rot. Bonds1

About (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine

(2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine (PubChem CID 86637037) has the molecular formula C4H3Cl2FN4 and a molecular weight of 197.00 g/mol. Its IUPAC name is (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine
PubChem CID86637037
Molecular FormulaC4H3Cl2FN4
Molecular Weight197.00 g/mol
Exact Mass195.97
IUPAC Name(2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine
SMILESNNc1nc(Cl)nc(Cl)c1F
InChIInChI=1S/C4H3Cl2FN4/c5-2-1(7)3(11-8)10-4(6)9-2/h8H2,(H,9,10,11)
InChIKeyPGFAXTWMSLDHDZ-UHFFFAOYSA-N
XLogP1.21
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.00
LogP ≤ 51.21
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 (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine?
The IUPAC name of (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine (CID 86637037) is (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine.
What is the SMILES notation for (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine?
The canonical SMILES for (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine is NNc1nc(Cl)nc(Cl)c1F.
What is the InChIKey of (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine?
The InChIKey is PGFAXTWMSLDHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3Cl2FN4/c5-2-1(7)3(11-8)10-4(6)9-2/h8H2,(H,9,10,11).
What are the key properties of (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine?
(2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine has a molecular weight of 197.00 g/mol, XLogP of 1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dichloro-5-fluoropyrimidin-4-yl)hydrazine is sourced from PubChem (CID 86637037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).