[5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine

C14H17NO2 — CID 102907457

IUPAC[5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine
SMILESCOCCc1ccccc1-c1ccc(CN)o1
InChIInChI=1S/C14H17NO2/c1-16-9-8-11-4-2-3-5-13(11)14-7-6-12(10-15)17-14/h2-7H,8-10,15H2,1H3
InChIKeyCJUUQLWROJJTSD-UHFFFAOYSA-N
MW231.29 g/mol
LogP2.59
Rot. Bonds5

About [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine

[5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine (PubChem CID 102907457) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine.

Molecular Properties

Compound Name[5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine
PubChem CID102907457
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name[5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine
SMILESCOCCc1ccccc1-c1ccc(CN)o1
InChIInChI=1S/C14H17NO2/c1-16-9-8-11-4-2-3-5-13(11)14-7-6-12(10-15)17-14/h2-7H,8-10,15H2,1H3
InChIKeyCJUUQLWROJJTSD-UHFFFAOYSA-N
XLogP2.59
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine?
The IUPAC name of [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine (CID 102907457) is [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine.
What is the SMILES notation for [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine?
The canonical SMILES for [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine is COCCc1ccccc1-c1ccc(CN)o1.
What is the InChIKey of [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine?
The InChIKey is CJUUQLWROJJTSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-16-9-8-11-4-2-3-5-13(11)14-7-6-12(10-15)17-14/h2-7H,8-10,15H2,1H3.
What are the key properties of [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine?
[5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine has a molecular weight of 231.29 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine is sourced from PubChem (CID 102907457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).