4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine

C5H8ClN5 — CID 57352786

IUPAC4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine
SMILESCc1nc(Cl)c(N)c(NN)n1
InChIInChI=1S/C5H8ClN5/c1-2-9-4(6)3(7)5(10-2)11-8/h7-8H2,1H3,(H,9,10,11)
InChIKeyFUASEBAJOMWRAG-UHFFFAOYSA-N
MW173.61 g/mol
LogP0.31
Rot. Bonds1

About 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine

4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine (PubChem CID 57352786) has the molecular formula C5H8ClN5 and a molecular weight of 173.61 g/mol. Its IUPAC name is 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine.

Molecular Properties

Compound Name4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine
PubChem CID57352786
Molecular FormulaC5H8ClN5
Molecular Weight173.61 g/mol
Exact Mass173.05
IUPAC Name4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine
SMILESCc1nc(Cl)c(N)c(NN)n1
InChIInChI=1S/C5H8ClN5/c1-2-9-4(6)3(7)5(10-2)11-8/h7-8H2,1H3,(H,9,10,11)
InChIKeyFUASEBAJOMWRAG-UHFFFAOYSA-N
XLogP0.31
TPSA89.85 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.61
LogP ≤ 50.31
H-Bond Donors ≤ 53
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 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine?
The IUPAC name of 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine (CID 57352786) is 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine.
What is the SMILES notation for 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine?
The canonical SMILES for 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine is Cc1nc(Cl)c(N)c(NN)n1.
What is the InChIKey of 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine?
The InChIKey is FUASEBAJOMWRAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8ClN5/c1-2-9-4(6)3(7)5(10-2)11-8/h7-8H2,1H3,(H,9,10,11).
What are the key properties of 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine?
4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine has a molecular weight of 173.61 g/mol, XLogP of 0.31, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-hydrazinyl-2-methylpyrimidin-5-amine is sourced from PubChem (CID 57352786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).