3-amino-4-methoxy-3-methylbutan-1-ol

C6H15NO2 — CID 65240020

IUPAC3-amino-4-methoxy-3-methylbutan-1-ol
SMILESCOCC(C)(N)CCO
InChIInChI=1S/C6H15NO2/c1-6(7,3-4-8)5-9-2/h8H,3-5,7H2,1-2H3
InChIKeyOSKKFJANHDTOGL-UHFFFAOYSA-N
MW133.19 g/mol
LogP-0.27
Rot. Bonds4

About 3-amino-4-methoxy-3-methylbutan-1-ol

3-amino-4-methoxy-3-methylbutan-1-ol (PubChem CID 65240020) has the molecular formula C6H15NO2 and a molecular weight of 133.19 g/mol. Its IUPAC name is 3-amino-4-methoxy-3-methylbutan-1-ol.

Molecular Properties

Compound Name3-amino-4-methoxy-3-methylbutan-1-ol
PubChem CID65240020
Molecular FormulaC6H15NO2
Molecular Weight133.19 g/mol
Exact Mass133.11
IUPAC Name3-amino-4-methoxy-3-methylbutan-1-ol
SMILESCOCC(C)(N)CCO
InChIInChI=1S/C6H15NO2/c1-6(7,3-4-8)5-9-2/h8H,3-5,7H2,1-2H3
InChIKeyOSKKFJANHDTOGL-UHFFFAOYSA-N
XLogP-0.27
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-2-ethyl-1,3-propanediol
CID 8282
3-Amino-3-methylbutan-1-ol
CID 641000
2-Amino-2-methylbutan-1-ol
CID 10154017
2-Amino-3-methoxy-2-methylpropan-1-ol
CID 13375415
(3-Aminooxolan-3-yl)methanol
CID 58134851
2-Amino-2-(hydroxymethyl)butane-1,4-diol
CID 18435579
2-(3-Aminooxetan-3-yl)ethan-1-ol hydrochloride
CID 132351242
Tris(hydroxymethyl)aminopropane
CID 21313541
(2S)-2-Amino-2-methylbutan-1-ol
CID 42579762
2-(3-Aminooxetan-3-yl)ethanol
CID 71432942
2-Amino-2-methyl-4-(2,2,2-trifluoroethoxy)butan-1-ol
CID 64804913
2-Amino-4-(2,2-difluoroethoxy)-2-methylbutan-1-ol
CID 82009567

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-methoxy-3-methylbutan-1-ol?
The IUPAC name of 3-amino-4-methoxy-3-methylbutan-1-ol (CID 65240020) is 3-amino-4-methoxy-3-methylbutan-1-ol.
What is the SMILES notation for 3-amino-4-methoxy-3-methylbutan-1-ol?
The canonical SMILES for 3-amino-4-methoxy-3-methylbutan-1-ol is COCC(C)(N)CCO.
What is the InChIKey of 3-amino-4-methoxy-3-methylbutan-1-ol?
The InChIKey is OSKKFJANHDTOGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2/c1-6(7,3-4-8)5-9-2/h8H,3-5,7H2,1-2H3.
What are the key properties of 3-amino-4-methoxy-3-methylbutan-1-ol?
3-amino-4-methoxy-3-methylbutan-1-ol has a molecular weight of 133.19 g/mol, XLogP of -0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-methoxy-3-methylbutan-1-ol is sourced from PubChem (CID 65240020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).