1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol

C8H19NO3 — CID 64821675

IUPAC1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol
SMILESCOCC(C)OCC(C)(O)CN
InChIInChI=1S/C8H19NO3/c1-7(4-11-3)12-6-8(2,10)5-9/h7,10H,4-6,9H2,1-3H3
InChIKeyVATLZCHYHVFVFJ-UHFFFAOYSA-N
MW177.24 g/mol
LogP-0.25
Rot. Bonds6

About 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol

1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol (PubChem CID 64821675) has the molecular formula C8H19NO3 and a molecular weight of 177.24 g/mol. Its IUPAC name is 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol
PubChem CID64821675
Molecular FormulaC8H19NO3
Molecular Weight177.24 g/mol
Exact Mass177.14
IUPAC Name1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol
SMILESCOCC(C)OCC(C)(O)CN
InChIInChI=1S/C8H19NO3/c1-7(4-11-3)12-6-8(2,10)5-9/h7,10H,4-6,9H2,1-3H3
InChIKeyVATLZCHYHVFVFJ-UHFFFAOYSA-N
XLogP-0.25
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.24
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-Amino-3-(propan-2-yloxy)propan-2-ol
CID 662350
1-Amino-3-(2-methylpropoxy)propan-2-ol
CID 14142114
1-Amino-3-ethoxypropan-2-ol
CID 15683480
1-Amino-3-(tert-butoxy)propan-2-ol
CID 19012483
1-Amino-3-methoxy-2-methylpropan-2-ol
CID 54592891
1-(2-Aminoethoxy)-2-methylpropan-2-ol hydrochloride
CID 86645446
1-Amino-3-(2-(2-methoxyethoxy)ethoxy)propan-2-ol
CID 112693098
1-Amino-3-(2-ethoxyethoxy)propan-2-OL
CID 20116620
1-Amino-3-propoxy-2-propanol
CID 43248035
1-Amino-3-butoxypropan-2-ol
CID 19910807
1-(2-Aminoethoxy)-2-methylpropan-2-ol
CID 22924906
1-Amino-2-methyl-3-(1,1,1-trifluoropropan-2-yloxy)propan-2-ol
CID 66279037

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol?
The IUPAC name of 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol (CID 64821675) is 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol.
What is the SMILES notation for 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol?
The canonical SMILES for 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol is COCC(C)OCC(C)(O)CN.
What is the InChIKey of 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol?
The InChIKey is VATLZCHYHVFVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO3/c1-7(4-11-3)12-6-8(2,10)5-9/h7,10H,4-6,9H2,1-3H3.
What are the key properties of 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol?
1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol has a molecular weight of 177.24 g/mol, XLogP of -0.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(1-methoxypropan-2-yloxy)-2-methylpropan-2-ol is sourced from PubChem (CID 64821675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).