N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine

C13H23NO3 — CID 103490484

IUPACN-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine
SMILESCCNCc1ccoc1COC(C)COCC
InChIInChI=1S/C13H23NO3/c1-4-14-8-12-6-7-16-13(12)10-17-11(3)9-15-5-2/h6-7,11,14H,4-5,8-10H2,1-3H3
InChIKeyCAWCPVTYXUMBBW-UHFFFAOYSA-N
MW241.33 g/mol
LogP2.33
Rot. Bonds9

About N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine

N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine (PubChem CID 103490484) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine
PubChem CID103490484
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC NameN-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine
SMILESCCNCc1ccoc1COC(C)COCC
InChIInChI=1S/C13H23NO3/c1-4-14-8-12-6-7-16-13(12)10-17-11(3)9-15-5-2/h6-7,11,14H,4-5,8-10H2,1-3H3
InChIKeyCAWCPVTYXUMBBW-UHFFFAOYSA-N
XLogP2.33
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[3-(1-ethoxypropan-2-yloxymethyl)furan-2-yl]methyl]propan-1-amine
CID 103490562
N-[[3-(pentan-2-yloxymethyl)furan-2-yl]methyl]ethanamine
CID 102987125
3-(1-ethoxypropan-2-yloxymethyl)furan-2-carbohydrazide
CID 103490879
N-[[2-[(2-bromophenyl)methoxymethyl]furan-3-yl]methyl]ethanamine
CID 82825719
N-[[2-(butan-2-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62454822
N-[[2-(heptoxymethyl)furan-3-yl]methyl]ethanamine
CID 62455259
N-[[3-(3-methylbutoxymethyl)furan-2-yl]methyl]ethanamine
CID 62445339
N-[[3-(2-methylpropyl)furan-2-yl]methyl]ethanamine
CID 106887200
2-methyl-N-[[2-[2-(2-methylpropoxy)ethoxymethyl]furan-3-yl]methyl]propan-1-amine
CID 106449856
N-[[2-[(4-bromo-2-propan-2-ylphenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 115402761
N-[[2-[(3-methylphenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 62452706
N-[[2-[(2-tert-butylphenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 62452007

Frequently Asked Questions

What is the IUPAC name of N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine (CID 103490484) is N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine is CCNCc1ccoc1COC(C)COCC.
What is the InChIKey of N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine?
The InChIKey is CAWCPVTYXUMBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c1-4-14-8-12-6-7-16-13(12)10-17-11(3)9-15-5-2/h6-7,11,14H,4-5,8-10H2,1-3H3.
What are the key properties of N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine?
N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine has a molecular weight of 241.33 g/mol, XLogP of 2.33, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(1-ethoxypropan-2-yloxymethyl)furan-3-yl]methyl]ethanamine is sourced from PubChem (CID 103490484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).