2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol

C8H19NO2 — CID 175288171

IUPAC2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol
SMILESCC(C)(C)C(CO)OCCN
InChIInChI=1S/C8H19NO2/c1-8(2,3)7(6-10)11-5-4-9/h7,10H,4-6,9H2,1-3H3
InChIKeyACNLJCDFRFCRRO-UHFFFAOYSA-N
MW161.24 g/mol
LogP0.37
Rot. Bonds4

About 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol

2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol (PubChem CID 175288171) has the molecular formula C8H19NO2 and a molecular weight of 161.24 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol.

Molecular Properties

Compound Name2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol
PubChem CID175288171
Molecular FormulaC8H19NO2
Molecular Weight161.24 g/mol
Exact Mass161.14
IUPAC Name2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol
SMILESCC(C)(C)C(CO)OCCN
InChIInChI=1S/C8H19NO2/c1-8(2,3)7(6-10)11-5-4-9/h7,10H,4-6,9H2,1-3H3
InChIKeyACNLJCDFRFCRRO-UHFFFAOYSA-N
XLogP0.37
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.24
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-aminoethoxy)-2,2-dimethylpropan-1-ol
CID 123688713
3-(1-amino-3,3-dimethylbutan-2-yl)oxypropan-1-ol
CID 103377299
2-(2,2,6-trimethylheptan-3-yloxy)ethanol
CID 142712551
2-aminoethoxy(trihydroxy)phosphanium
CID 55290252
2-propan-2-yloxyethanamine
CID 533866
1-(2-aminoethoxy)ethanol;hydroxylamine
CID 87972798
3-[3-(2-aminoethoxy)butan-2-yloxy]propane-1,2-diol
CID 129092165
2-(2-hydroxy-1-methoxyethoxy)-3,3-dimethylbutan-1-ol
CID 118017315
1-(2-aminoethoxy)propan-1-ol
CID 87147915
[1-[2-(2-aminoethoxy)ethoxy]-3,3-dimethylbutan-2-yl] carbamate
CID 175096885
2-[1-(2-aminoethoxy)-2-hydroxyethyl]guanidine
CID 138685069
2-aminoethoxy(ethoxy)methanol
CID 155706478

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol?
The IUPAC name of 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol (CID 175288171) is 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol.
What is the SMILES notation for 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol?
The canonical SMILES for 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol is CC(C)(C)C(CO)OCCN.
What is the InChIKey of 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol?
The InChIKey is ACNLJCDFRFCRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-8(2,3)7(6-10)11-5-4-9/h7,10H,4-6,9H2,1-3H3.
What are the key properties of 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol?
2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol has a molecular weight of 161.24 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol is sourced from PubChem (CID 175288171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).