1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine

C4H9IN4 — CID 141188276

IUPAC1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine
SMILESNN(I)C1=NCCCN1
InChIInChI=1S/C4H9IN4/c5-9(6)4-7-2-1-3-8-4/h1-3,6H2,(H,7,8)
InChIKeyVWTJCDOPOSUSHV-UHFFFAOYSA-N
MW240.05 g/mol
LogP-0.14
Rot. Bonds

About 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine

1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine (PubChem CID 141188276) has the molecular formula C4H9IN4 and a molecular weight of 240.05 g/mol. Its IUPAC name is 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine.

Molecular Properties

Compound Name1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine
PubChem CID141188276
Molecular FormulaC4H9IN4
Molecular Weight240.05 g/mol
Exact Mass239.99
IUPAC Name1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine
SMILESNN(I)C1=NCCCN1
InChIInChI=1S/C4H9IN4/c5-9(6)4-7-2-1-3-8-4/h1-3,6H2,(H,7,8)
InChIKeyVWTJCDOPOSUSHV-UHFFFAOYSA-N
XLogP-0.14
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.05
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine?
The IUPAC name of 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine (CID 141188276) is 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine.
What is the SMILES notation for 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine?
The canonical SMILES for 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine is NN(I)C1=NCCCN1.
What is the InChIKey of 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine?
The InChIKey is VWTJCDOPOSUSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9IN4/c5-9(6)4-7-2-1-3-8-4/h1-3,6H2,(H,7,8).
What are the key properties of 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine?
1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine has a molecular weight of 240.05 g/mol, XLogP of -0.14, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodo-1-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine is sourced from PubChem (CID 141188276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).