2,2-dimethyl-5-propan-2-yloxypentanimidamide

C10H22N2O — CID 65258548

IUPAC2,2-dimethyl-5-propan-2-yloxypentanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCOC(C)C
InChIInChI=1S/C10H22N2O/c1-8(2)13-7-5-6-10(3,4)9(11)12/h8H,5-7H2,1-4H3,(H3,11,12)
InChIKeyZKOJQBZLCLKZCN-UHFFFAOYSA-N
MW186.30 g/mol
LogP2.15
Rot. Bonds6

About 2,2-dimethyl-5-propan-2-yloxypentanimidamide

2,2-dimethyl-5-propan-2-yloxypentanimidamide (PubChem CID 65258548) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2,2-dimethyl-5-propan-2-yloxypentanimidamide.

Molecular Properties

Compound Name2,2-dimethyl-5-propan-2-yloxypentanimidamide
PubChem CID65258548
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2,2-dimethyl-5-propan-2-yloxypentanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCOC(C)C
InChIInChI=1S/C10H22N2O/c1-8(2)13-7-5-6-10(3,4)9(11)12/h8H,5-7H2,1-4H3,(H3,11,12)
InChIKeyZKOJQBZLCLKZCN-UHFFFAOYSA-N
XLogP2.15
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 52.15
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-5-propan-2-yloxypentanimidamide?
The IUPAC name of 2,2-dimethyl-5-propan-2-yloxypentanimidamide (CID 65258548) is 2,2-dimethyl-5-propan-2-yloxypentanimidamide.
What is the SMILES notation for 2,2-dimethyl-5-propan-2-yloxypentanimidamide?
The canonical SMILES for 2,2-dimethyl-5-propan-2-yloxypentanimidamide is [H]/N=C(\N)C(C)(C)CCCOC(C)C.
What is the InChIKey of 2,2-dimethyl-5-propan-2-yloxypentanimidamide?
The InChIKey is ZKOJQBZLCLKZCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-8(2)13-7-5-6-10(3,4)9(11)12/h8H,5-7H2,1-4H3,(H3,11,12).
What are the key properties of 2,2-dimethyl-5-propan-2-yloxypentanimidamide?
2,2-dimethyl-5-propan-2-yloxypentanimidamide has a molecular weight of 186.30 g/mol, XLogP of 2.15, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-5-propan-2-yloxypentanimidamide is sourced from PubChem (CID 65258548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).