1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine

C15H19NO2 — CID 62452138

IUPAC1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
SMILESCCc1cccc(OCc2ccc(CNC)o2)c1
InChIInChI=1S/C15H19NO2/c1-3-12-5-4-6-13(9-12)17-11-15-8-7-14(18-15)10-16-2/h4-9,16H,3,10-11H2,1-2H3
InChIKeyGJXBSQPKOSJSON-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.14
Rot. Bonds6

About 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine

1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine (PubChem CID 62452138) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
PubChem CID62452138
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
SMILESCCc1cccc(OCc2ccc(CNC)o2)c1
InChIInChI=1S/C15H19NO2/c1-3-12-5-4-6-13(9-12)17-11-15-8-7-14(18-15)10-16-2/h4-9,16H,3,10-11H2,1-2H3
InChIKeyGJXBSQPKOSJSON-UHFFFAOYSA-N
XLogP3.14
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 18116
5-[(4-tert-butylphenoxy)methyl]-N-isopropyl-2-furamide
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[5-(3,4-Dimethyl-phenoxymethyl)-furan-2-yl]-pyrrolidin-1-yl-methanone
CID 1084328
5-[(2-methoxy-4-propylphenoxy)methyl]-N-propyl-2-furamide
CID 2166253
5-[(4-tert-butylphenoxy)methyl]-N-propyl-2-furamide
CID 2166341
5-[(2-methoxyphenoxy)methyl]-N-(1-phenylethyl)-2-furamide
CID 2942268
Benzyl(furan-2-ylmethyl)amine
CID 39338
N-benzylfuran-2-carboxamide
CID 347531
N-[2-(3,4-dimethoxyphenyl)ethyl]furan-2-carboxamide
CID 703899
N-(4-ethoxybenzyl)furan-2-carboxamide
CID 861821
[5-(4-Propyl-phenoxymethyl)-furan-2-yl]-pyrrolidin-1-yl-methanone
CID 1091762
5-[(4-methylphenoxy)methyl]-N-propyl-2-furamide
CID 2200397

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine (CID 62452138) is 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine is CCc1cccc(OCc2ccc(CNC)o2)c1.
What is the InChIKey of 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine?
The InChIKey is GJXBSQPKOSJSON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-3-12-5-4-6-13(9-12)17-11-15-8-7-14(18-15)10-16-2/h4-9,16H,3,10-11H2,1-2H3.
What are the key properties of 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine?
1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine has a molecular weight of 245.32 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine is sourced from PubChem (CID 62452138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).