3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine

C16H34N2O3 — CID 79911931

IUPAC3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine
SMILESCOCCN(C(C)COC)C1(CN)CC(C)(C)OC1(C)C
InChIInChI=1S/C16H34N2O3/c1-13(10-20-7)18(8-9-19-6)16(12-17)11-14(2,3)21-15(16,4)5/h13H,8-12,17H2,1-7H3
InChIKeyOKJATRSKASTFQO-UHFFFAOYSA-N
MW302.46 g/mol
LogP1.64
Rot. Bonds8

About 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine

3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine (PubChem CID 79911931) has the molecular formula C16H34N2O3 and a molecular weight of 302.46 g/mol. Its IUPAC name is 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine
PubChem CID79911931
Molecular FormulaC16H34N2O3
Molecular Weight302.46 g/mol
Exact Mass302.26
IUPAC Name3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine
SMILESCOCCN(C(C)COC)C1(CN)CC(C)(C)OC1(C)C
InChIInChI=1S/C16H34N2O3/c1-13(10-20-7)18(8-9-19-6)16(12-17)11-14(2,3)21-15(16,4)5/h13H,8-12,17H2,1-7H3
InChIKeyOKJATRSKASTFQO-UHFFFAOYSA-N
XLogP1.64
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine?
The IUPAC name of 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine (CID 79911931) is 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine?
The canonical SMILES for 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine is COCCN(C(C)COC)C1(CN)CC(C)(C)OC1(C)C.
What is the InChIKey of 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine?
The InChIKey is OKJATRSKASTFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O3/c1-13(10-20-7)18(8-9-19-6)16(12-17)11-14(2,3)21-15(16,4)5/h13H,8-12,17H2,1-7H3.
What are the key properties of 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine?
3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine has a molecular weight of 302.46 g/mol, XLogP of 1.64, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2,5,5-tetramethyloxolan-3-amine is sourced from PubChem (CID 79911931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).