[5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine

C10H17NO3 — CID 62444313

IUPAC[5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine
SMILESCCOCCOCc1cc(CN)co1
InChIInChI=1S/C10H17NO3/c1-2-12-3-4-13-8-10-5-9(6-11)7-14-10/h5,7H,2-4,6,8,11H2,1H3
InChIKeyGIMYJSRHGQLLER-UHFFFAOYSA-N
MW199.25 g/mol
LogP1.29
Rot. Bonds7

About [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine

[5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine (PubChem CID 62444313) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine.

Molecular Properties

Compound Name[5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine
PubChem CID62444313
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name[5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine
SMILESCCOCCOCc1cc(CN)co1
InChIInChI=1S/C10H17NO3/c1-2-12-3-4-13-8-10-5-9(6-11)7-14-10/h5,7H,2-4,6,8,11H2,1H3
InChIKeyGIMYJSRHGQLLER-UHFFFAOYSA-N
XLogP1.29
TPSA57.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.29
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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Related Compounds

[5-(butoxymethyl)furan-3-yl]methanamine
CID 62451528
[5-(3-methylbutoxymethyl)furan-3-yl]methanamine
CID 62444987
N-[2-[[4-(aminomethyl)furan-2-yl]methoxy]ethyl]-N-propan-2-ylpropan-2-amine
CID 113325033
N-[[4-(aminomethyl)furan-2-yl]methyl]-2-ethoxy-N-methylethanamine
CID 81067939
[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine
CID 62457457
[5-[2-(4-methyl-1,3-thiazol-5-yl)ethoxymethyl]furan-3-yl]methanamine
CID 62443614
5-(2-ethoxyethoxymethyl)furan-3-carbohydrazide
CID 63588537
[5-[(4-butylphenoxy)methyl]furan-3-yl]methanamine
CID 115493308
[5-(oxetan-3-yloxymethyl)furan-3-yl]methanamine
CID 102608146
N-[[5-(pentoxymethyl)furan-3-yl]methyl]ethanamine
CID 62450269
[5-[(2,6-dimethoxyphenoxy)methyl]furan-3-yl]methanamine
CID 62449636
[5-[(4-methylsulfanylphenoxy)methyl]furan-3-yl]methanamine
CID 63648763

Frequently Asked Questions

What is the IUPAC name of [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine?
The IUPAC name of [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine (CID 62444313) is [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine.
What is the SMILES notation for [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine?
The canonical SMILES for [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine is CCOCCOCc1cc(CN)co1.
What is the InChIKey of [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine?
The InChIKey is GIMYJSRHGQLLER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-2-12-3-4-13-8-10-5-9(6-11)7-14-10/h5,7H,2-4,6,8,11H2,1H3.
What are the key properties of [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine?
[5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine has a molecular weight of 199.25 g/mol, XLogP of 1.29, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-ethoxyethoxymethyl)furan-3-yl]methanamine is sourced from PubChem (CID 62444313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).