6-cyclohexyloxy-2,2-dimethylhexanimidamide

C14H28N2O — CID 106712305

IUPAC6-cyclohexyloxy-2,2-dimethylhexanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCCOC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-14(2,13(15)16)10-6-7-11-17-12-8-4-3-5-9-12/h12H,3-11H2,1-2H3,(H3,15,16)
InChIKeyUNVRDXBCCFTWBY-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.47
Rot. Bonds7

About 6-cyclohexyloxy-2,2-dimethylhexanimidamide

6-cyclohexyloxy-2,2-dimethylhexanimidamide (PubChem CID 106712305) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 6-cyclohexyloxy-2,2-dimethylhexanimidamide.

Molecular Properties

Compound Name6-cyclohexyloxy-2,2-dimethylhexanimidamide
PubChem CID106712305
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name6-cyclohexyloxy-2,2-dimethylhexanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCCOC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-14(2,13(15)16)10-6-7-11-17-12-8-4-3-5-9-12/h12H,3-11H2,1-2H3,(H3,15,16)
InChIKeyUNVRDXBCCFTWBY-UHFFFAOYSA-N
XLogP3.47
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyloxy-2,2-dimethylhexanimidamide?
The IUPAC name of 6-cyclohexyloxy-2,2-dimethylhexanimidamide (CID 106712305) is 6-cyclohexyloxy-2,2-dimethylhexanimidamide.
What is the SMILES notation for 6-cyclohexyloxy-2,2-dimethylhexanimidamide?
The canonical SMILES for 6-cyclohexyloxy-2,2-dimethylhexanimidamide is [H]/N=C(\N)C(C)(C)CCCCOC1CCCCC1.
What is the InChIKey of 6-cyclohexyloxy-2,2-dimethylhexanimidamide?
The InChIKey is UNVRDXBCCFTWBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-14(2,13(15)16)10-6-7-11-17-12-8-4-3-5-9-12/h12H,3-11H2,1-2H3,(H3,15,16).
What are the key properties of 6-cyclohexyloxy-2,2-dimethylhexanimidamide?
6-cyclohexyloxy-2,2-dimethylhexanimidamide has a molecular weight of 240.39 g/mol, XLogP of 3.47, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyloxy-2,2-dimethylhexanimidamide is sourced from PubChem (CID 106712305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).