2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine

C12H27NO2 — CID 135280779

IUPAC2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine
SMILESCOCC(C)(CNC(C)C)COC(C)C
InChIInChI=1S/C12H27NO2/c1-10(2)13-7-12(5,8-14-6)9-15-11(3)4/h10-11,13H,7-9H2,1-6H3
InChIKeyTZWDUEARAIVXTO-UHFFFAOYSA-N
MW217.35 g/mol
LogP2.06
Rot. Bonds8

About 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine

2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine (PubChem CID 135280779) has the molecular formula C12H27NO2 and a molecular weight of 217.35 g/mol. Its IUPAC name is 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine
PubChem CID135280779
Molecular FormulaC12H27NO2
Molecular Weight217.35 g/mol
Exact Mass217.20
IUPAC Name2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine
SMILESCOCC(C)(CNC(C)C)COC(C)C
InChIInChI=1S/C12H27NO2/c1-10(2)13-7-12(5,8-14-6)9-15-11(3)4/h10-11,13H,7-9H2,1-6H3
InChIKeyTZWDUEARAIVXTO-UHFFFAOYSA-N
XLogP2.06
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.35
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine?
The IUPAC name of 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine (CID 135280779) is 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine is COCC(C)(CNC(C)C)COC(C)C.
What is the InChIKey of 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine?
The InChIKey is TZWDUEARAIVXTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO2/c1-10(2)13-7-12(5,8-14-6)9-15-11(3)4/h10-11,13H,7-9H2,1-6H3.
What are the key properties of 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine?
2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine has a molecular weight of 217.35 g/mol, XLogP of 2.06, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-2-methyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine is sourced from PubChem (CID 135280779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).