3-(3-methoxyfuran-2-yl)propan-1-amine

C8H13NO2 — CID 166040043

IUPAC3-(3-methoxyfuran-2-yl)propan-1-amine
SMILESCOc1ccoc1CCCN
InChIInChI=1S/C8H13NO2/c1-10-7-4-6-11-8(7)3-2-5-9/h4,6H,2-3,5,9H2,1H3
InChIKeyWATIWXCHQFPUKT-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.18
Rot. Bonds4

About 3-(3-methoxyfuran-2-yl)propan-1-amine

3-(3-methoxyfuran-2-yl)propan-1-amine (PubChem CID 166040043) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 3-(3-methoxyfuran-2-yl)propan-1-amine.

Molecular Properties

Compound Name3-(3-methoxyfuran-2-yl)propan-1-amine
PubChem CID166040043
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name3-(3-methoxyfuran-2-yl)propan-1-amine
SMILESCOc1ccoc1CCCN
InChIInChI=1S/C8H13NO2/c1-10-7-4-6-11-8(7)3-2-5-9/h4,6H,2-3,5,9H2,1H3
InChIKeyWATIWXCHQFPUKT-UHFFFAOYSA-N
XLogP1.18
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyfuran-2-yl)propan-1-amine?
The IUPAC name of 3-(3-methoxyfuran-2-yl)propan-1-amine (CID 166040043) is 3-(3-methoxyfuran-2-yl)propan-1-amine.
What is the SMILES notation for 3-(3-methoxyfuran-2-yl)propan-1-amine?
The canonical SMILES for 3-(3-methoxyfuran-2-yl)propan-1-amine is COc1ccoc1CCCN.
What is the InChIKey of 3-(3-methoxyfuran-2-yl)propan-1-amine?
The InChIKey is WATIWXCHQFPUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-10-7-4-6-11-8(7)3-2-5-9/h4,6H,2-3,5,9H2,1H3.
What are the key properties of 3-(3-methoxyfuran-2-yl)propan-1-amine?
3-(3-methoxyfuran-2-yl)propan-1-amine has a molecular weight of 155.20 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyfuran-2-yl)propan-1-amine is sourced from PubChem (CID 166040043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).