2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol

C11H25NO3 — CID 142624921

IUPAC2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol
SMILESCC(C)(CO)OCCC(C)(C)OCCN
InChIInChI=1S/C11H25NO3/c1-10(2,15-8-6-12)5-7-14-11(3,4)9-13/h13H,5-9,12H2,1-4H3
InChIKeyLRIAPLIRUFHOKW-UHFFFAOYSA-N
MW219.32 g/mol
LogP0.92
Rot. Bonds8

About 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol

2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol (PubChem CID 142624921) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol
PubChem CID142624921
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC Name2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol
SMILESCC(C)(CO)OCCC(C)(C)OCCN
InChIInChI=1S/C11H25NO3/c1-10(2,15-8-6-12)5-7-14-11(3,4)9-13/h13H,5-9,12H2,1-4H3
InChIKeyLRIAPLIRUFHOKW-UHFFFAOYSA-N
XLogP0.92
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.32
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[[4-(5-amino-2-methylpentan-2-yl)oxy-2-methylbutan-2-yl]oxymethyl]-3-[1-(5-amino-2-methylpentan-2-yl)oxy-2-methylpropan-2-yl]oxy-2-[[1-(5-amino-2-methylpentan-2-yl)oxy-2-methylpropan-2-yl]oxymethyl]propoxy]-2-methylpropan-1-ol
CID 174354791
2-(3,3-dimethylbutoxy)-2-methylpropan-1-ol
CID 123870350
4-[3-(3-aminopropoxy)-3-methylbutoxy]-4-methylpentan-1-amine
CID 88566862
N-[3-[3-(2-aminoethoxy)-3-methylbutoxy]-3-methylbutyl]acetamide
CID 122606411
2-[3-[2-(2,2-dimethylbutoxy)-2-methylpropoxy]-3-methylbutoxy]-2-methylpropan-1-ol
CID 90360547
O-[2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylbutyl]hydroxylamine
CID 123603845
3-[4-(4-methoxy-2-methylbutan-2-yl)oxy-2-methylbutan-2-yl]oxypropan-1-amine
CID 88578913
2-(2-hydrazinylethoxy)-2-methylpropan-1-ol
CID 126700280
3-[3-(2-aminoethoxy)-3-methylbutoxy]-N,3-dimethylbutan-1-amine;propanal
CID 145317497
[5-(2-aminoethoxy)-2,5-dimethylhexan-2-yl]carbamic acid
CID 175166936
3-(3,3-dimethylpentoxy)-3-methylbutan-1-amine
CID 91197205
2-[2-[[2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropyl]amino]-2-oxoethoxy]acetic acid
CID 89044576

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol?
The IUPAC name of 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol (CID 142624921) is 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol?
The canonical SMILES for 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol is CC(C)(CO)OCCC(C)(C)OCCN.
What is the InChIKey of 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol?
The InChIKey is LRIAPLIRUFHOKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-10(2,15-8-6-12)5-7-14-11(3,4)9-13/h13H,5-9,12H2,1-4H3.
What are the key properties of 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol?
2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol has a molecular weight of 219.32 g/mol, XLogP of 0.92, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-aminoethoxy)-3-methylbutoxy]-2-methylpropan-1-ol is sourced from PubChem (CID 142624921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).