2,2,5,5-tetramethyl-N-propyloxolan-3-amine

C11H23NO — CID 75356337

IUPAC2,2,5,5-tetramethyl-N-propyloxolan-3-amine
SMILESCCCNC1CC(C)(C)OC1(C)C
InChIInChI=1S/C11H23NO/c1-6-7-12-9-8-10(2,3)13-11(9,4)5/h9,12H,6-8H2,1-5H3
InChIKeyRDZRPKCYFYJZII-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.33
Rot. Bonds3

About 2,2,5,5-tetramethyl-N-propyloxolan-3-amine

2,2,5,5-tetramethyl-N-propyloxolan-3-amine (PubChem CID 75356337) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-N-propyloxolan-3-amine.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-N-propyloxolan-3-amine
PubChem CID75356337
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2,2,5,5-tetramethyl-N-propyloxolan-3-amine
SMILESCCCNC1CC(C)(C)OC1(C)C
InChIInChI=1S/C11H23NO/c1-6-7-12-9-8-10(2,3)13-11(9,4)5/h9,12H,6-8H2,1-5H3
InChIKeyRDZRPKCYFYJZII-UHFFFAOYSA-N
XLogP2.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.33
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-propyloxolan-3-amine?
The IUPAC name of 2,2,5,5-tetramethyl-N-propyloxolan-3-amine (CID 75356337) is 2,2,5,5-tetramethyl-N-propyloxolan-3-amine.
What is the SMILES notation for 2,2,5,5-tetramethyl-N-propyloxolan-3-amine?
The canonical SMILES for 2,2,5,5-tetramethyl-N-propyloxolan-3-amine is CCCNC1CC(C)(C)OC1(C)C.
What is the InChIKey of 2,2,5,5-tetramethyl-N-propyloxolan-3-amine?
The InChIKey is RDZRPKCYFYJZII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-6-7-12-9-8-10(2,3)13-11(9,4)5/h9,12H,6-8H2,1-5H3.
What are the key properties of 2,2,5,5-tetramethyl-N-propyloxolan-3-amine?
2,2,5,5-tetramethyl-N-propyloxolan-3-amine has a molecular weight of 185.31 g/mol, XLogP of 2.33, 3 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-propyloxolan-3-amine is sourced from PubChem (CID 75356337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).