1-iodo-2-[methyl(methylamino)amino]ethanol

C4H11IN2O — CID 166768311

IUPAC1-iodo-2-[methyl(methylamino)amino]ethanol
SMILESCNN(C)CC(O)I
InChIInChI=1S/C4H11IN2O/c1-6-7(2)3-4(5)8/h4,6,8H,3H2,1-2H3
InChIKeyMUQRNAIXNVBDJL-UHFFFAOYSA-N
MW230.05 g/mol
LogP-0.19
Rot. Bonds3

About 1-iodo-2-[methyl(methylamino)amino]ethanol

1-iodo-2-[methyl(methylamino)amino]ethanol (PubChem CID 166768311) has the molecular formula C4H11IN2O and a molecular weight of 230.05 g/mol. Its IUPAC name is 1-iodo-2-[methyl(methylamino)amino]ethanol.

Molecular Properties

Compound Name1-iodo-2-[methyl(methylamino)amino]ethanol
PubChem CID166768311
Molecular FormulaC4H11IN2O
Molecular Weight230.05 g/mol
Exact Mass229.99
IUPAC Name1-iodo-2-[methyl(methylamino)amino]ethanol
SMILESCNN(C)CC(O)I
InChIInChI=1S/C4H11IN2O/c1-6-7(2)3-4(5)8/h4,6,8H,3H2,1-2H3
InChIKeyMUQRNAIXNVBDJL-UHFFFAOYSA-N
XLogP-0.19
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.05
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-[2-hydroxy-3-[methyl(methylamino)amino]propyl]acetamide
CID 143072607
5-[methyl(methylamino)amino]pentan-2-ol
CID 123798269
1-[methylamino(sulfanyl)amino]propan-2-ol
CID 174895381
1-(chloromethyl)-1,2-dimethylhydrazine
CID 152614480
1-(dimethylamino)-3-(methylamino)propan-2-ol
CID 12700841
4-[[methyl(methylamino)amino]methyl]phenol
CID 152516052
amino-[methyl(methylamino)amino]methanol
CID 140976107
1-(2,2-dimethylpropyl)-1,2-dimethylhydrazine
CID 87405842
(2S)-1-[[bis[(2R)-2-hydroxypropyl]amino]-[(2S)-2-hydroxypropyl]amino]propan-2-ol
CID 92557045
(2R)-1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol
CID 103668529
1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol
CID 62337944
2-bromo-N'-(2-methylpropyl)-N'-(2-oxoethyl)acetohydrazide;1,2-dimethyl-1-(2-methylpropyl)hydrazine
CID 142215971

Frequently Asked Questions

What is the IUPAC name of 1-iodo-2-[methyl(methylamino)amino]ethanol?
The IUPAC name of 1-iodo-2-[methyl(methylamino)amino]ethanol (CID 166768311) is 1-iodo-2-[methyl(methylamino)amino]ethanol.
What is the SMILES notation for 1-iodo-2-[methyl(methylamino)amino]ethanol?
The canonical SMILES for 1-iodo-2-[methyl(methylamino)amino]ethanol is CNN(C)CC(O)I.
What is the InChIKey of 1-iodo-2-[methyl(methylamino)amino]ethanol?
The InChIKey is MUQRNAIXNVBDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11IN2O/c1-6-7(2)3-4(5)8/h4,6,8H,3H2,1-2H3.
What are the key properties of 1-iodo-2-[methyl(methylamino)amino]ethanol?
1-iodo-2-[methyl(methylamino)amino]ethanol has a molecular weight of 230.05 g/mol, XLogP of -0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodo-2-[methyl(methylamino)amino]ethanol is sourced from PubChem (CID 166768311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).