N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine

C17H23NO2 — CID 63085668

IUPACN-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine
SMILESCCOCc1ccccc1CNC(C)Cc1ccco1
InChIInChI=1S/C17H23NO2/c1-3-19-13-16-8-5-4-7-15(16)12-18-14(2)11-17-9-6-10-20-17/h4-10,14,18H,3,11-13H2,1-2H3
InChIKeyMNSNRUFKYVVNMS-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.54
Rot. Bonds8

About N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine

N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine (PubChem CID 63085668) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine.

Molecular Properties

Compound NameN-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine
PubChem CID63085668
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC NameN-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine
SMILESCCOCc1ccccc1CNC(C)Cc1ccco1
InChIInChI=1S/C17H23NO2/c1-3-19-13-16-8-5-4-7-15(16)12-18-14(2)11-17-9-6-10-20-17/h4-10,14,18H,3,11-13H2,1-2H3
InChIKeyMNSNRUFKYVVNMS-UHFFFAOYSA-N
XLogP3.54
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[2-[[1-(furan-2-yl)propan-2-ylamino]methyl]phenyl]acetate
CID 115461702
N-(3-ethoxypropyl)-1-(furan-2-yl)propan-2-amine
CID 63099763
N-[(2-fluoro-3-methoxyphenyl)methyl]-1-(furan-2-yl)propan-2-amine
CID 104791634
4-[[1-(furan-2-yl)propan-2-ylamino]methyl]phenol
CID 43432836
N-(2,2-diethoxyethyl)-1-(furan-2-yl)propan-2-amine
CID 79547595
1-(furan-2-yl)-N-[(4-propan-2-yloxyphenyl)methyl]propan-2-amine
CID 43783131
N-[[2-(ethoxymethyl)phenyl]methyl]-2,6-dimethylheptan-4-amine
CID 63448148
1-(furan-2-yl)-N-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methyl]propan-2-amine
CID 43783211
1-(furan-2-yl)-N-[(2-methylquinolin-4-yl)methyl]propan-2-amine
CID 78943029
2-[[1-(furan-2-yl)propan-2-ylamino]methyl]-5-methoxyaniline
CID 115413933
1-(furan-2-yl)-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]propan-2-amine
CID 62475299
(2S)-1-(furan-2-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propan-2-amine
CID 93264764

Frequently Asked Questions

What is the IUPAC name of N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine?
The IUPAC name of N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine (CID 63085668) is N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine.
What is the SMILES notation for N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine?
The canonical SMILES for N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine is CCOCc1ccccc1CNC(C)Cc1ccco1.
What is the InChIKey of N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine?
The InChIKey is MNSNRUFKYVVNMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-3-19-13-16-8-5-4-7-15(16)12-18-14(2)11-17-9-6-10-20-17/h4-10,14,18H,3,11-13H2,1-2H3.
What are the key properties of N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine?
N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine has a molecular weight of 273.38 g/mol, XLogP of 3.54, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(ethoxymethyl)phenyl]methyl]-1-(furan-2-yl)propan-2-amine is sourced from PubChem (CID 63085668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).