4-[iodo(methyl)amino]cyclohexan-1-ol

C7H14INO — CID 143163205

IUPAC4-[iodo(methyl)amino]cyclohexan-1-ol
SMILESCN(I)C1CCC(O)CC1
InChIInChI=1S/C7H14INO/c1-9(8)6-2-4-7(10)5-3-6/h6-7,10H,2-5H2,1H3
InChIKeyOIFDUDULHNUPJO-UHFFFAOYSA-N
MW255.10 g/mol
LogP1.57
Rot. Bonds1

About 4-[iodo(methyl)amino]cyclohexan-1-ol

4-[iodo(methyl)amino]cyclohexan-1-ol (PubChem CID 143163205) has the molecular formula C7H14INO and a molecular weight of 255.10 g/mol. Its IUPAC name is 4-[iodo(methyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[iodo(methyl)amino]cyclohexan-1-ol
PubChem CID143163205
Molecular FormulaC7H14INO
Molecular Weight255.10 g/mol
Exact Mass255.01
IUPAC Name4-[iodo(methyl)amino]cyclohexan-1-ol
SMILESCN(I)C1CCC(O)CC1
InChIInChI=1S/C7H14INO/c1-9(8)6-2-4-7(10)5-3-6/h6-7,10H,2-5H2,1H3
InChIKeyOIFDUDULHNUPJO-UHFFFAOYSA-N
XLogP1.57
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.10
LogP ≤ 51.57
H-Bond Donors ≤ 51
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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Related Compounds

4-(dimethylamino)cyclohexan-1-ol;vanadium
CID 176696741
4-[cyclobutyl(methyl)amino]cyclohexan-1-ol
CID 114762700
cyclohexane-1,4-diol
CID 11162
N-iodo-N,1-dimethylpiperidin-4-amine
CID 134413074
3-[ethyl(methyl)amino]cyclopentan-1-ol
CID 79643360
4-[1-cyclopropylethyl(methyl)amino]cyclohexan-1-ol
CID 114762400
cyclohexane-1,4-diol;hydrochloride
CID 141062883
4-[methyl-(2-methylcyclohexyl)amino]cyclohexan-1-ol
CID 114762511
N-(4-hydroxycyclohexyl)-N-methylpropane-2-sulfonamide
CID 115277390
4-(N,4-dimethylanilino)cyclohexan-1-ol
CID 114762541
3-[tert-butyl(methyl)amino]cyclopentan-1-ol
CID 131071048
4-(2,2-dimethylhydrazinyl)cyclohexan-1-ol
CID 106594980

Frequently Asked Questions

What is the IUPAC name of 4-[iodo(methyl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[iodo(methyl)amino]cyclohexan-1-ol (CID 143163205) is 4-[iodo(methyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[iodo(methyl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[iodo(methyl)amino]cyclohexan-1-ol is CN(I)C1CCC(O)CC1.
What is the InChIKey of 4-[iodo(methyl)amino]cyclohexan-1-ol?
The InChIKey is OIFDUDULHNUPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14INO/c1-9(8)6-2-4-7(10)5-3-6/h6-7,10H,2-5H2,1H3.
What are the key properties of 4-[iodo(methyl)amino]cyclohexan-1-ol?
4-[iodo(methyl)amino]cyclohexan-1-ol has a molecular weight of 255.10 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[iodo(methyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 143163205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).