N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine

C15H19NO2 — CID 63948564

IUPACN-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine
SMILESCCNC(CCOc1ccccc1)c1ccoc1
InChIInChI=1S/C15H19NO2/c1-2-16-15(13-8-10-17-12-13)9-11-18-14-6-4-3-5-7-14/h3-8,10,12,15-16H,2,9,11H2,1H3
InChIKeyGOANTQYOWQGDHM-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.40
Rot. Bonds7

About N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine

N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine (PubChem CID 63948564) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine
PubChem CID63948564
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC NameN-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine
SMILESCCNC(CCOc1ccccc1)c1ccoc1
InChIInChI=1S/C15H19NO2/c1-2-16-15(13-8-10-17-12-13)9-11-18-14-6-4-3-5-7-14/h3-8,10,12,15-16H,2,9,11H2,1H3
InChIKeyGOANTQYOWQGDHM-UHFFFAOYSA-N
XLogP3.40
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine?
The IUPAC name of N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine (CID 63948564) is N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine.
What is the SMILES notation for N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine?
The canonical SMILES for N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine is CCNC(CCOc1ccccc1)c1ccoc1.
What is the InChIKey of N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine?
The InChIKey is GOANTQYOWQGDHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-2-16-15(13-8-10-17-12-13)9-11-18-14-6-4-3-5-7-14/h3-8,10,12,15-16H,2,9,11H2,1H3.
What are the key properties of N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine?
N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine has a molecular weight of 245.32 g/mol, XLogP of 3.40, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(furan-3-yl)-3-phenoxypropan-1-amine is sourced from PubChem (CID 63948564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).