1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine

C15H19NO2 — CID 113259789

IUPAC1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
SMILESCOc1ccccc1CCNC(C)c1ccoc1
InChIInChI=1S/C15H19NO2/c1-12(14-8-10-18-11-14)16-9-7-13-5-3-4-6-15(13)17-2/h3-6,8,10-12,16H,7,9H2,1-2H3
InChIKeyCXPCKDZRKHNFDG-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.18
Rot. Bonds6

About 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine

1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine (PubChem CID 113259789) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine.

Molecular Properties

Compound Name1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
PubChem CID113259789
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine
SMILESCOc1ccccc1CCNC(C)c1ccoc1
InChIInChI=1S/C15H19NO2/c1-12(14-8-10-18-11-14)16-9-7-13-5-3-4-6-15(13)17-2/h3-6,8,10-12,16H,7,9H2,1-2H3
InChIKeyCXPCKDZRKHNFDG-UHFFFAOYSA-N
XLogP3.18
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The IUPAC name of 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine (CID 113259789) is 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine.
What is the SMILES notation for 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The canonical SMILES for 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine is COc1ccccc1CCNC(C)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The InChIKey is CXPCKDZRKHNFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-12(14-8-10-18-11-14)16-9-7-13-5-3-4-6-15(13)17-2/h3-6,8,10-12,16H,7,9H2,1-2H3.
What are the key properties of 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine has a molecular weight of 245.32 g/mol, XLogP of 3.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-N-[2-(2-methoxyphenyl)ethyl]ethanamine is sourced from PubChem (CID 113259789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).