2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane

C5H15IN3- — CID 163571956

IUPAC2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane
SMILESCNNN[I-]CC(C)C
InChIInChI=1S/C5H15IN3/c1-5(2)4-6-8-9-7-3/h5,7-9H,4H2,1-3H3/q-1
InChIKeyCCPODYYCVULZKL-UHFFFAOYSA-N
MW244.10 g/mol
LogP-3.12
Rot. Bonds5

About 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane

2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane (PubChem CID 163571956) has the molecular formula C5H15IN3- and a molecular weight of 244.10 g/mol. Its IUPAC name is 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane.

Molecular Properties

Compound Name2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane
PubChem CID163571956
Molecular FormulaC5H15IN3-
Molecular Weight244.10 g/mol
Exact Mass244.03
IUPAC Name2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane
SMILESCNNN[I-]CC(C)C
InChIInChI=1S/C5H15IN3/c1-5(2)4-6-8-9-7-3/h5,7-9H,4H2,1-3H3/q-1
InChIKeyCCPODYYCVULZKL-UHFFFAOYSA-N
XLogP-3.12
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.10
LogP ≤ 5-3.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', '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'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane?
The IUPAC name of 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane (CID 163571956) is 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane.
What is the SMILES notation for 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane?
The canonical SMILES for 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane is CNNN[I-]CC(C)C.
What is the InChIKey of 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane?
The InChIKey is CCPODYYCVULZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15IN3/c1-5(2)4-6-8-9-7-3/h5,7-9H,4H2,1-3H3/q-1.
What are the key properties of 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane?
2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane has a molecular weight of 244.10 g/mol, XLogP of -3.12, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[2-(methylamino)hydrazinyl]iodanuidylpropane is sourced from PubChem (CID 163571956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).