cyclohexanamine;methoxymethanol

C8H19NO2 — CID 143263350

IUPACcyclohexanamine;methoxymethanol
SMILESCOCO.NC1CCCCC1
InChIInChI=1S/C6H13N.C2H6O2/c7-6-4-2-1-3-5-6;1-4-2-3/h6H,1-5,7H2;3H,2H2,1H3
InChIKeyXLUVIFABPZGYBR-UHFFFAOYSA-N
MW161.24 g/mol
LogP0.86
Rot. Bonds1

About cyclohexanamine;methoxymethanol

cyclohexanamine;methoxymethanol (PubChem CID 143263350) has the molecular formula C8H19NO2 and a molecular weight of 161.24 g/mol. Its IUPAC name is cyclohexanamine;methoxymethanol.

Molecular Properties

Compound Namecyclohexanamine;methoxymethanol
PubChem CID143263350
Molecular FormulaC8H19NO2
Molecular Weight161.24 g/mol
Exact Mass161.14
IUPAC Namecyclohexanamine;methoxymethanol
SMILESCOCO.NC1CCCCC1
InChIInChI=1S/C6H13N.C2H6O2/c7-6-4-2-1-3-5-6;1-4-2-3/h6H,1-5,7H2;3H,2H2,1H3
InChIKeyXLUVIFABPZGYBR-UHFFFAOYSA-N
XLogP0.86
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.24
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

cyclohexanamine;ethanol
CID 159108869
cycloheptanamine;ethanol
CID 158239152
cyclobutanamine;2-methoxyethanol
CID 156885948
cyclohexanamine;3-methoxyprop-1-yne
CID 145333221
azane;cycloheptanamine
CID 135353953
cyclohexanamine;2,2,2-trifluoroethanol
CID 173402481
3-aminopropan-1-ol;cyclooctanamine
CID 22649733
carbanide;cyclododecanamine;titanium(2+)
CID 174995468
cyclohexanamine;thiohydroxylamine
CID 143520299
bis(cycloheptanamine);platinum(2+);dichloride
CID 3038593
CID 175698442
CID 175698442
azane;cyclopentanamine
CID 69254255

Frequently Asked Questions

What is the IUPAC name of cyclohexanamine;methoxymethanol?
The IUPAC name of cyclohexanamine;methoxymethanol (CID 143263350) is cyclohexanamine;methoxymethanol.
What is the SMILES notation for cyclohexanamine;methoxymethanol?
The canonical SMILES for cyclohexanamine;methoxymethanol is COCO.NC1CCCCC1.
What is the InChIKey of cyclohexanamine;methoxymethanol?
The InChIKey is XLUVIFABPZGYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.C2H6O2/c7-6-4-2-1-3-5-6;1-4-2-3/h6H,1-5,7H2;3H,2H2,1H3.
What are the key properties of cyclohexanamine;methoxymethanol?
cyclohexanamine;methoxymethanol has a molecular weight of 161.24 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexanamine;methoxymethanol is sourced from PubChem (CID 143263350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).