1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine

C8H15NO — CID 130579424

IUPAC1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine
SMILESCC(C)C(N)C1=COCC1
InChIInChI=1S/C8H15NO/c1-6(2)8(9)7-3-4-10-5-7/h5-6,8H,3-4,9H2,1-2H3
InChIKeySAOOXUZVKOMDAN-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.27
Rot. Bonds2

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

1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine (PubChem CID 130579424) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine
PubChem CID130579424
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine
SMILESCC(C)C(N)C1=COCC1
InChIInChI=1S/C8H15NO/c1-6(2)8(9)7-3-4-10-5-7/h5-6,8H,3-4,9H2,1-2H3
InChIKeySAOOXUZVKOMDAN-UHFFFAOYSA-N
XLogP1.27
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine?
The IUPAC name of 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine (CID 130579424) is 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine?
The canonical SMILES for 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine is CC(C)C(N)C1=COCC1.
What is the InChIKey of 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine?
The InChIKey is SAOOXUZVKOMDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6(2)8(9)7-3-4-10-5-7/h5-6,8H,3-4,9H2,1-2H3.
What are the key properties of 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine?
1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine has a molecular weight of 141.21 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-4-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 130579424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).