[ethyl(2-methylheptan-2-yl)amino] hypoiodite

C10H22INO — CID 156748473

IUPAC[ethyl(2-methylheptan-2-yl)amino] hypoiodite
SMILESCCCCCC(C)(C)N(CC)OI
InChIInChI=1S/C10H22INO/c1-5-7-8-9-10(3,4)12(6-2)13-11/h5-9H2,1-4H3
InChIKeyWTSYFEKHVDEVEQ-UHFFFAOYSA-N
MW299.20 g/mol
LogP3.95
Rot. Bonds7

About [ethyl(2-methylheptan-2-yl)amino] hypoiodite

[ethyl(2-methylheptan-2-yl)amino] hypoiodite (PubChem CID 156748473) has the molecular formula C10H22INO and a molecular weight of 299.20 g/mol. Its IUPAC name is [ethyl(2-methylheptan-2-yl)amino] hypoiodite.

Molecular Properties

Compound Name[ethyl(2-methylheptan-2-yl)amino] hypoiodite
PubChem CID156748473
Molecular FormulaC10H22INO
Molecular Weight299.20 g/mol
Exact Mass299.07
IUPAC Name[ethyl(2-methylheptan-2-yl)amino] hypoiodite
SMILESCCCCCC(C)(C)N(CC)OI
InChIInChI=1S/C10H22INO/c1-5-7-8-9-10(3,4)12(6-2)13-11/h5-9H2,1-4H3
InChIKeyWTSYFEKHVDEVEQ-UHFFFAOYSA-N
XLogP3.95
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.20
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethoxy-N-ethyl-2-methylheptadecan-2-amine
CID 174442183
N-ethyl-2-methyl-N-phenoxytridecan-2-amine
CID 88748114
N-ethyl-2-methyl-N-(2-methyloctan-2-yl)octan-2-amine
CID 139724053
N-ethyl-2-methyl-N-(2-methyldodecan-2-yl)dodecan-2-amine
CID 139723254
N-(1-adamantyloxy)-N-ethyl-2-methylpentadecan-2-amine;hydrobromide
CID 173445402
N,N,2-trimethyltridecan-2-amine;hydrochloride
CID 175023190
N-hexyl-2-methyl-N-(2-methylheptadecan-2-yl)heptadecan-2-amine
CID 139723065
2-methyl-N-(2-methyltridecan-2-yl)-N-nonyltridecan-2-amine
CID 139723690
N,N-bis(2-methyldecan-2-yl)dodecan-1-amine
CID 139723612
N,N-bis(2-methyldecan-2-yl)tridecan-1-amine
CID 139723232
N,N-bis(2-methyloctan-2-yl)pentadecan-1-amine
CID 139723897
2-methyl-N-(2-methylundecan-2-yl)-N-nonylundecan-2-amine
CID 139723201

Frequently Asked Questions

What is the IUPAC name of [ethyl(2-methylheptan-2-yl)amino] hypoiodite?
The IUPAC name of [ethyl(2-methylheptan-2-yl)amino] hypoiodite (CID 156748473) is [ethyl(2-methylheptan-2-yl)amino] hypoiodite.
What is the SMILES notation for [ethyl(2-methylheptan-2-yl)amino] hypoiodite?
The canonical SMILES for [ethyl(2-methylheptan-2-yl)amino] hypoiodite is CCCCCC(C)(C)N(CC)OI.
What is the InChIKey of [ethyl(2-methylheptan-2-yl)amino] hypoiodite?
The InChIKey is WTSYFEKHVDEVEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22INO/c1-5-7-8-9-10(3,4)12(6-2)13-11/h5-9H2,1-4H3.
What are the key properties of [ethyl(2-methylheptan-2-yl)amino] hypoiodite?
[ethyl(2-methylheptan-2-yl)amino] hypoiodite has a molecular weight of 299.20 g/mol, XLogP of 3.95, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [ethyl(2-methylheptan-2-yl)amino] hypoiodite is sourced from PubChem (CID 156748473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).