5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane

C17H38N2O2 — CID 166464908

IUPAC5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane
SMILESCC(CC(C)(C)OCC(C)(C)N)C(C)(C)C(N)=O.CCC
InChIInChI=1S/C14H30N2O2.C3H8/c1-10(14(6,7)11(15)17)8-13(4,5)18-9-12(2,3)16;1-3-2/h10H,8-9,16H2,1-7H3,(H2,15,17);3H2,1-2H3
InChIKeyBHBFJBACAVTTGX-UHFFFAOYSA-N
MW302.50 g/mol
LogP3.47
Rot. Bonds7

About 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane

5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane (PubChem CID 166464908) has the molecular formula C17H38N2O2 and a molecular weight of 302.50 g/mol. Its IUPAC name is 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane.

Molecular Properties

Compound Name5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane
PubChem CID166464908
Molecular FormulaC17H38N2O2
Molecular Weight302.50 g/mol
Exact Mass302.29
IUPAC Name5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane
SMILESCC(CC(C)(C)OCC(C)(C)N)C(C)(C)C(N)=O.CCC
InChIInChI=1S/C14H30N2O2.C3H8/c1-10(14(6,7)11(15)17)8-13(4,5)18-9-12(2,3)16;1-3-2/h10H,8-9,16H2,1-7H3,(H2,15,17);3H2,1-2H3
InChIKeyBHBFJBACAVTTGX-UHFFFAOYSA-N
XLogP3.47
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.50
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane?
The IUPAC name of 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane (CID 166464908) is 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane.
What is the SMILES notation for 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane?
The canonical SMILES for 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane is CC(CC(C)(C)OCC(C)(C)N)C(C)(C)C(N)=O.CCC.
What is the InChIKey of 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane?
The InChIKey is BHBFJBACAVTTGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2.C3H8/c1-10(14(6,7)11(15)17)8-13(4,5)18-9-12(2,3)16;1-3-2/h10H,8-9,16H2,1-7H3,(H2,15,17);3H2,1-2H3.
What are the key properties of 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane?
5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane has a molecular weight of 302.50 g/mol, XLogP of 3.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-2-methylpropoxy)-2,2,3,5-tetramethylhexanamide;propane is sourced from PubChem (CID 166464908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).