N-(furan-2-ylmethyl)-2-methoxyethanamine

C8H13NO2 — CID 4722632

IUPACN-(furan-2-ylmethyl)-2-methoxyethanamine
SMILESCOCCNCc1ccco1
InChIInChI=1S/C8H13NO2/c1-10-6-4-9-7-8-3-2-5-11-8/h2-3,5,9H,4,6-7H2,1H3
InChIKeySORZPLSUZRRMRL-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.02
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-methoxyethanamine

N-(furan-2-ylmethyl)-2-methoxyethanamine (PubChem CID 4722632) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-methoxyethanamine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-methoxyethanamine
PubChem CID4722632
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC NameN-(furan-2-ylmethyl)-2-methoxyethanamine
SMILESCOCCNCc1ccco1
InChIInChI=1S/C8H13NO2/c1-10-6-4-9-7-8-3-2-5-11-8/h2-3,5,9H,4,6-7H2,1H3
InChIKeySORZPLSUZRRMRL-UHFFFAOYSA-N
XLogP1.02
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-methoxyethanamine?
The IUPAC name of N-(furan-2-ylmethyl)-2-methoxyethanamine (CID 4722632) is N-(furan-2-ylmethyl)-2-methoxyethanamine.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-methoxyethanamine?
The canonical SMILES for N-(furan-2-ylmethyl)-2-methoxyethanamine is COCCNCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-methoxyethanamine?
The InChIKey is SORZPLSUZRRMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-10-6-4-9-7-8-3-2-5-11-8/h2-3,5,9H,4,6-7H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-2-methoxyethanamine?
N-(furan-2-ylmethyl)-2-methoxyethanamine has a molecular weight of 155.20 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-methoxyethanamine is sourced from PubChem (CID 4722632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).