2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine

C16H32N2O — CID 106602894

IUPAC2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine
SMILESCC(C)N(CC1CCCN1)C1CC(C)(C)OC1(C)C
InChIInChI=1S/C16H32N2O/c1-12(2)18(11-13-8-7-9-17-13)14-10-15(3,4)19-16(14,5)6/h12-14,17H,7-11H2,1-6H3
InChIKeyWLCOIADNCOLUHS-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.79
Rot. Bonds4

About 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine

2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine (PubChem CID 106602894) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine
PubChem CID106602894
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine
SMILESCC(C)N(CC1CCCN1)C1CC(C)(C)OC1(C)C
InChIInChI=1S/C16H32N2O/c1-12(2)18(11-13-8-7-9-17-13)14-10-15(3,4)19-16(14,5)6/h12-14,17H,7-11H2,1-6H3
InChIKeyWLCOIADNCOLUHS-UHFFFAOYSA-N
XLogP2.79
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,5,5-tetramethyl-N-(piperidin-2-ylmethyl)-N-propyloxolan-3-amine
CID 106623281
2,2-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yloxan-4-amine
CID 106622299
4,4-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106622300
N-(piperidin-2-ylmethyl)-N-propan-2-yloxetan-3-amine
CID 176601027
N-methyl-N-[[(2R)-pyrrolidin-2-yl]methyl]propan-2-amine;molecular hydrogen
CID 177210581
3,3,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106622016
N-[(5,5-dimethyloxolan-2-yl)methyl]-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 106614880
1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine
CID 106603013
N,3-di(propan-2-yl)-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 107449580
N-(piperidin-2-ylmethyl)-N-propan-2-yl-5-oxaspiro[3.5]nonan-8-amine
CID 106632077
N-(piperidin-2-ylmethyl)-N-propan-2-yloxolan-3-amine
CID 106622294
N-ethyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 43265935

Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine?
The IUPAC name of 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine (CID 106602894) is 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine.
What is the SMILES notation for 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine?
The canonical SMILES for 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine is CC(C)N(CC1CCCN1)C1CC(C)(C)OC1(C)C.
What is the InChIKey of 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine?
The InChIKey is WLCOIADNCOLUHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-12(2)18(11-13-8-7-9-17-13)14-10-15(3,4)19-16(14,5)6/h12-14,17H,7-11H2,1-6H3.
What are the key properties of 2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine?
2,2,5,5-tetramethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine has a molecular weight of 268.44 g/mol, XLogP of 2.79, 4 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-propan-2-yl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine is sourced from PubChem (CID 106602894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).