3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine

C10H17NO2 — CID 62997867

IUPAC3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine
SMILESCCOCCCNCc1ccoc1
InChIInChI=1S/C10H17NO2/c1-2-12-6-3-5-11-8-10-4-7-13-9-10/h4,7,9,11H,2-3,5-6,8H2,1H3
InChIKeyKNBIGSMLZOYEMC-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.80
Rot. Bonds7

About 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine

3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine (PubChem CID 62997867) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine
PubChem CID62997867
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine
SMILESCCOCCCNCc1ccoc1
InChIInChI=1S/C10H17NO2/c1-2-12-6-3-5-11-8-10-4-7-13-9-10/h4,7,9,11H,2-3,5-6,8H2,1H3
InChIKeyKNBIGSMLZOYEMC-UHFFFAOYSA-N
XLogP1.80
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.80
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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Related Compounds

N-(furan-3-ylmethyl)-3-methoxypropan-1-amine
CID 62997873
N-(furan-3-ylmethyl)-2-pent-4-enoxyethanamine
CID 79114939
3-ethoxy-N-[(4-methylphenyl)methyl]propan-1-amine
CID 4716360
2-[2-(furan-3-ylmethylamino)ethoxy]ethanol
CID 63032955
1-(furan-3-yl)-N-(furan-3-ylmethyl)methanamine
CID 115607346
N-ethoxy-1-(furan-3-yl)methanamine
CID 82709352
3-ethoxy-N-(1H-pyrrol-3-ylmethyl)propan-1-amine
CID 66408485
N-(furan-3-ylmethyl)-2-[2-(2-methylpropoxy)ethoxy]ethanamine
CID 106450221
N-(furan-3-ylmethyl)-N'-propan-2-ylethane-1,2-diamine
CID 62560326
4,4,4-trifluoro-N-(furan-3-ylmethyl)butan-1-amine
CID 79038889
4-[(3-ethoxypropylamino)methyl]-N,N-diethylaniline
CID 4719418
N-[(3,4-dichlorophenyl)methyl]-3-ethoxypropan-1-amine
CID 4719417

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine?
The IUPAC name of 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine (CID 62997867) is 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine.
What is the SMILES notation for 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine?
The canonical SMILES for 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine is CCOCCCNCc1ccoc1.
What is the InChIKey of 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine?
The InChIKey is KNBIGSMLZOYEMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-2-12-6-3-5-11-8-10-4-7-13-9-10/h4,7,9,11H,2-3,5-6,8H2,1H3.
What are the key properties of 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine?
3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine has a molecular weight of 183.25 g/mol, XLogP of 1.80, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(furan-3-ylmethyl)propan-1-amine is sourced from PubChem (CID 62997867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).