5-iodo-5-methylcyclodecan-1-amine

C11H22IN — CID 166972339

IUPAC5-iodo-5-methylcyclodecan-1-amine
SMILESCC1(I)CCCCCC(N)CCC1
InChIInChI=1S/C11H22IN/c1-11(12)8-4-2-3-6-10(13)7-5-9-11/h10H,2-9,13H2,1H3
InChIKeyIZPSXJHBYSQNPY-UHFFFAOYSA-N
MW295.21 g/mol
LogP3.64
Rot. Bonds

About 5-iodo-5-methylcyclodecan-1-amine

5-iodo-5-methylcyclodecan-1-amine (PubChem CID 166972339) has the molecular formula C11H22IN and a molecular weight of 295.21 g/mol. Its IUPAC name is 5-iodo-5-methylcyclodecan-1-amine.

Molecular Properties

Compound Name5-iodo-5-methylcyclodecan-1-amine
PubChem CID166972339
Molecular FormulaC11H22IN
Molecular Weight295.21 g/mol
Exact Mass295.08
IUPAC Name5-iodo-5-methylcyclodecan-1-amine
SMILESCC1(I)CCCCCC(N)CCC1
InChIInChI=1S/C11H22IN/c1-11(12)8-4-2-3-6-10(13)7-5-9-11/h10H,2-9,13H2,1H3
InChIKeyIZPSXJHBYSQNPY-UHFFFAOYSA-N
XLogP3.64
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-iodo-3-methylcyclohexan-1-amine
CID 156750072
azane;cycloheptanamine
CID 135353953
cyclohexanamine;thiohydroxylamine
CID 143520299
carbanide;cyclododecanamine;titanium(2+)
CID 174995468
bis(cycloheptanamine);platinum(2+);dichloride
CID 3038593
CID 175698442
CID 175698442
azane;cyclopentanamine
CID 69254255
cyclopentanamine;platinum(2+)
CID 21144800
spiro[5.6]dodecan-3-amine
CID 56639662
cyclohexanamine;ethanol
CID 159108869
5-methylcyclododecan-1-amine
CID 138488786
cycloheptanamine;ethanol
CID 158239152

Frequently Asked Questions

What is the IUPAC name of 5-iodo-5-methylcyclodecan-1-amine?
The IUPAC name of 5-iodo-5-methylcyclodecan-1-amine (CID 166972339) is 5-iodo-5-methylcyclodecan-1-amine.
What is the SMILES notation for 5-iodo-5-methylcyclodecan-1-amine?
The canonical SMILES for 5-iodo-5-methylcyclodecan-1-amine is CC1(I)CCCCCC(N)CCC1.
What is the InChIKey of 5-iodo-5-methylcyclodecan-1-amine?
The InChIKey is IZPSXJHBYSQNPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22IN/c1-11(12)8-4-2-3-6-10(13)7-5-9-11/h10H,2-9,13H2,1H3.
What are the key properties of 5-iodo-5-methylcyclodecan-1-amine?
5-iodo-5-methylcyclodecan-1-amine has a molecular weight of 295.21 g/mol, XLogP of 3.64, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodo-5-methylcyclodecan-1-amine is sourced from PubChem (CID 166972339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).