2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol

C8H15NO2 — CID 130589378

IUPAC2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol
SMILESCC(C)(N)C(O)C1=COCC1
InChIInChI=1S/C8H15NO2/c1-8(2,9)7(10)6-3-4-11-5-6/h5,7,10H,3-4,9H2,1-2H3
InChIKeySXKFFZPZHQAXIS-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.39
Rot. Bonds2

About 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol

2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol (PubChem CID 130589378) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol
PubChem CID130589378
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol
SMILESCC(C)(N)C(O)C1=COCC1
InChIInChI=1S/C8H15NO2/c1-8(2,9)7(10)6-3-4-11-5-6/h5,7,10H,3-4,9H2,1-2H3
InChIKeySXKFFZPZHQAXIS-UHFFFAOYSA-N
XLogP0.39
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-Dihydrofuran-4-yl)-2-methyl-2-(methylamino)propan-1-ol
CID 130589684
2-Amino-1-(4,5-dihydrofuran-3-yl)propan-1-ol
CID 164658402
2-amino-2-(3,4-dihydro-2H-pyran-5-yl)propan-1-ol
CID 165781096

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol?
The IUPAC name of 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol (CID 130589378) is 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol?
The canonical SMILES for 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol is CC(C)(N)C(O)C1=COCC1.
What is the InChIKey of 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol?
The InChIKey is SXKFFZPZHQAXIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-8(2,9)7(10)6-3-4-11-5-6/h5,7,10H,3-4,9H2,1-2H3.
What are the key properties of 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol?
2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol has a molecular weight of 157.21 g/mol, XLogP of 0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 130589378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).