N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine

C10H17NO3 — CID 62565000

IUPACN-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine
SMILESCOCCNCCOCc1ccco1
InChIInChI=1S/C10H17NO3/c1-12-7-4-11-5-8-13-9-10-3-2-6-14-10/h2-3,6,11H,4-5,7-9H2,1H3
InChIKeyCRGKXRABODAMJK-UHFFFAOYSA-N
MW199.25 g/mol
LogP1.03
Rot. Bonds8

About N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine

N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine (PubChem CID 62565000) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine.

Molecular Properties

Compound NameN-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine
PubChem CID62565000
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC NameN-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine
SMILESCOCCNCCOCc1ccco1
InChIInChI=1S/C10H17NO3/c1-12-7-4-11-5-8-13-9-10-3-2-6-14-10/h2-3,6,11H,4-5,7-9H2,1H3
InChIKeyCRGKXRABODAMJK-UHFFFAOYSA-N
XLogP1.03
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine?
The IUPAC name of N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine (CID 62565000) is N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine.
What is the SMILES notation for N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine?
The canonical SMILES for N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine is COCCNCCOCc1ccco1.
What is the InChIKey of N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine?
The InChIKey is CRGKXRABODAMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-12-7-4-11-5-8-13-9-10-3-2-6-14-10/h2-3,6,11H,4-5,7-9H2,1H3.
What are the key properties of N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine?
N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine has a molecular weight of 199.25 g/mol, XLogP of 1.03, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine is sourced from PubChem (CID 62565000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).