2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine

C17H34N2O — CID 106623281

IUPAC2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine
SMILESCCCN(CC1CCCCN1)C1CC(C)(C)OC1(C)C
InChIInChI=1S/C17H34N2O/c1-6-11-19(13-14-9-7-8-10-18-14)15-12-16(2,3)20-17(15,4)5/h14-15,18H,6-13H2,1-5H3
InChIKeyFGGBNWKZIRCSQH-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.19
Rot. Bonds5

About 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine

2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine (PubChem CID 106623281) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine
PubChem CID106623281
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine
SMILESCCCN(CC1CCCCN1)C1CC(C)(C)OC1(C)C
InChIInChI=1S/C17H34N2O/c1-6-11-19(13-14-9-7-8-10-18-14)15-12-16(2,3)20-17(15,4)5/h14-15,18H,6-13H2,1-5H3
InChIKeyFGGBNWKZIRCSQH-UHFFFAOYSA-N
XLogP3.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine
CID 106602894
N-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexanamine
CID 106603994
N-propyl-N-(pyrrolidin-2-ylmethyl)oxan-4-amine
CID 106604067
2-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)cyclopentan-1-amine
CID 106604021
N-propyl-N-(pyrrolidin-2-ylmethyl)-6-oxaspiro[4.5]decan-9-amine
CID 106615997
N-propyl-N-(pyrrolidin-2-ylmethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 106615927
N-butyl-N-[[(2R)-piperidin-2-yl]methyl]butan-1-amine
CID 28983352
N-(2-ethylsulfanylethyl)-N-(piperidin-2-ylmethyl)propan-1-amine
CID 106635829
N-ethyl-2,4,4-trimethyl-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
CID 106622647
4-[propyl(pyrrolidin-2-ylmethyl)amino]azepan-2-one
CID 106615853
2-[piperidin-2-ylmethyl(propyl)amino]acetonitrile
CID 106636097
N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide
CID 106625676

Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine?
The IUPAC name of 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine (CID 106623281) is 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine.
What is the SMILES notation for 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine?
The canonical SMILES for 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine is CCCN(CC1CCCCN1)C1CC(C)(C)OC1(C)C.
What is the InChIKey of 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine?
The InChIKey is FGGBNWKZIRCSQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-6-11-19(13-14-9-7-8-10-18-14)15-12-16(2,3)20-17(15,4)5/h14-15,18H,6-13H2,1-5H3.
What are the key properties of 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine?
2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine has a molecular weight of 282.47 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine is sourced from PubChem (CID 106623281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).