N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine

C10H23NO — CID 89212058

IUPACN-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine
SMILESCN(OCC(C)(C)C)C(C)(C)C
InChIInChI=1S/C10H23NO/c1-9(2,3)8-12-11(7)10(4,5)6/h8H2,1-7H3
InChIKeyYPADEBZOYYRZCT-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.69
Rot. Bonds2

About N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine

N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine (PubChem CID 89212058) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine
PubChem CID89212058
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC NameN-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine
SMILESCN(OCC(C)(C)C)C(C)(C)C
InChIInChI=1S/C10H23NO/c1-9(2,3)8-12-11(7)10(4,5)6/h8H2,1-7H3
InChIKeyYPADEBZOYYRZCT-UHFFFAOYSA-N
XLogP2.69
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine?
The IUPAC name of N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine (CID 89212058) is N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine.
What is the SMILES notation for N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine?
The canonical SMILES for N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine is CN(OCC(C)(C)C)C(C)(C)C.
What is the InChIKey of N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine?
The InChIKey is YPADEBZOYYRZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-9(2,3)8-12-11(7)10(4,5)6/h8H2,1-7H3.
What are the key properties of N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine?
N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine has a molecular weight of 173.30 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropoxy)-N,2-dimethylpropan-2-amine is sourced from PubChem (CID 89212058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).