2,2-dimethyl-6-propan-2-yloxyhexanimidamide

C11H24N2O — CID 106712323

IUPAC2,2-dimethyl-6-propan-2-yloxyhexanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCCOC(C)C
InChIInChI=1S/C11H24N2O/c1-9(2)14-8-6-5-7-11(3,4)10(12)13/h9H,5-8H2,1-4H3,(H3,12,13)
InChIKeyNHZHSWVHFZZESM-UHFFFAOYSA-N
MW200.33 g/mol
LogP2.54
Rot. Bonds7

About 2,2-dimethyl-6-propan-2-yloxyhexanimidamide

2,2-dimethyl-6-propan-2-yloxyhexanimidamide (PubChem CID 106712323) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2,2-dimethyl-6-propan-2-yloxyhexanimidamide.

Molecular Properties

Compound Name2,2-dimethyl-6-propan-2-yloxyhexanimidamide
PubChem CID106712323
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2,2-dimethyl-6-propan-2-yloxyhexanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCCOC(C)C
InChIInChI=1S/C11H24N2O/c1-9(2)14-8-6-5-7-11(3,4)10(12)13/h9H,5-8H2,1-4H3,(H3,12,13)
InChIKeyNHZHSWVHFZZESM-UHFFFAOYSA-N
XLogP2.54
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 52.54
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 2,2-dimethyl-6-propan-2-yloxyhexanimidamide?
The IUPAC name of 2,2-dimethyl-6-propan-2-yloxyhexanimidamide (CID 106712323) is 2,2-dimethyl-6-propan-2-yloxyhexanimidamide.
What is the SMILES notation for 2,2-dimethyl-6-propan-2-yloxyhexanimidamide?
The canonical SMILES for 2,2-dimethyl-6-propan-2-yloxyhexanimidamide is [H]/N=C(\N)C(C)(C)CCCCOC(C)C.
What is the InChIKey of 2,2-dimethyl-6-propan-2-yloxyhexanimidamide?
The InChIKey is NHZHSWVHFZZESM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-9(2)14-8-6-5-7-11(3,4)10(12)13/h9H,5-8H2,1-4H3,(H3,12,13).
What are the key properties of 2,2-dimethyl-6-propan-2-yloxyhexanimidamide?
2,2-dimethyl-6-propan-2-yloxyhexanimidamide has a molecular weight of 200.33 g/mol, XLogP of 2.54, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-propan-2-yloxyhexanimidamide is sourced from PubChem (CID 106712323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).