1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine

C7H17IN2 — CID 134444790

IUPAC1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine
SMILESCN(I)CC(C)(C)N(C)C
InChIInChI=1S/C7H17IN2/c1-7(2,9(3)4)6-10(5)8/h6H2,1-5H3
InChIKeyAWVPJVXXYSFRJI-UHFFFAOYSA-N
MW256.13 g/mol
LogP1.61
Rot. Bonds3

About 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine

1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine (PubChem CID 134444790) has the molecular formula C7H17IN2 and a molecular weight of 256.13 g/mol. Its IUPAC name is 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine
PubChem CID134444790
Molecular FormulaC7H17IN2
Molecular Weight256.13 g/mol
Exact Mass256.04
IUPAC Name1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine
SMILESCN(I)CC(C)(C)N(C)C
InChIInChI=1S/C7H17IN2/c1-7(2,9(3)4)6-10(5)8/h6H2,1-5H3
InChIKeyAWVPJVXXYSFRJI-UHFFFAOYSA-N
XLogP1.61
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.13
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine?
The IUPAC name of 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine (CID 134444790) is 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine.
What is the SMILES notation for 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine?
The canonical SMILES for 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine is CN(I)CC(C)(C)N(C)C.
What is the InChIKey of 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine?
The InChIKey is AWVPJVXXYSFRJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17IN2/c1-7(2,9(3)4)6-10(5)8/h6H2,1-5H3.
What are the key properties of 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine?
1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine has a molecular weight of 256.13 g/mol, XLogP of 1.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-iodo-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine is sourced from PubChem (CID 134444790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).