2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine

C15H31NO — CID 102613662

IUPAC2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine
SMILESCC(C)C(C)(C)CNC1CC(C)(C)OC1(C)C
InChIInChI=1S/C15H31NO/c1-11(2)13(3,4)10-16-12-9-14(5,6)17-15(12,7)8/h11-12,16H,9-10H2,1-8H3
InChIKeyRNOBHPYXKQZVPA-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.60
Rot. Bonds4

About 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine

2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine (PubChem CID 102613662) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine
PubChem CID102613662
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine
SMILESCC(C)C(C)(C)CNC1CC(C)(C)OC1(C)C
InChIInChI=1S/C15H31NO/c1-11(2)13(3,4)10-16-12-9-14(5,6)17-15(12,7)8/h11-12,16H,9-10H2,1-8H3
InChIKeyRNOBHPYXKQZVPA-UHFFFAOYSA-N
XLogP3.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine?
The IUPAC name of 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine (CID 102613662) is 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine.
What is the SMILES notation for 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine?
The canonical SMILES for 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine is CC(C)C(C)(C)CNC1CC(C)(C)OC1(C)C.
What is the InChIKey of 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine?
The InChIKey is RNOBHPYXKQZVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-11(2)13(3,4)10-16-12-9-14(5,6)17-15(12,7)8/h11-12,16H,9-10H2,1-8H3.
What are the key properties of 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine?
2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine has a molecular weight of 241.42 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-N-(2,2,3-trimethylbutyl)oxolan-3-amine is sourced from PubChem (CID 102613662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).