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

1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine
CID 63986399
1-[5-[(3-bromophenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62459188
1-[5-[(3-ethylphenoxy)methyl]-3-methylfuran-2-yl]-N-methylmethanamine
CID 62451776
N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine
CID 106486033
1-[3-[(5-bromofuran-2-yl)methoxy]phenyl]-N-methylmethanamine
CID 106485972
N-methyl-1-[5-[(3-methylsulfonylphenoxy)methyl]furan-2-yl]methanamine
CID 62484331
N-methyl-1-[5-(naphthalen-2-yloxymethyl)furan-2-yl]methanamine
CID 62460500
1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62453412
1-[5-[(3,5-difluorophenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62783791
N-[[5-[(3-ethylphenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62450321
1-[3-(furan-2-ylmethoxy)phenyl]-N-methylmethanamine;hydrochloride
CID 67855263
N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine
CID 62454887

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).