N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine

C15H26N2O2 — CID 62435009

IUPACN-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine
SMILESCCNCc1cc(CN(C)CC2CCCO2)oc1C
InChIInChI=1S/C15H26N2O2/c1-4-16-9-13-8-15(19-12(13)2)11-17(3)10-14-6-5-7-18-14/h8,14,16H,4-7,9-11H2,1-3H3
InChIKeyHUSAPYFLZDFBMJ-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.31
Rot. Bonds7

About N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine

N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine (PubChem CID 62435009) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine
PubChem CID62435009
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine
SMILESCCNCc1cc(CN(C)CC2CCCO2)oc1C
InChIInChI=1S/C15H26N2O2/c1-4-16-9-13-8-15(19-12(13)2)11-17(3)10-14-6-5-7-18-14/h8,14,16H,4-7,9-11H2,1-3H3
InChIKeyHUSAPYFLZDFBMJ-UHFFFAOYSA-N
XLogP2.31
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine (CID 62435009) is N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine is CCNCc1cc(CN(C)CC2CCCO2)oc1C.
What is the InChIKey of N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine?
The InChIKey is HUSAPYFLZDFBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-4-16-9-13-8-15(19-12(13)2)11-17(3)10-14-6-5-7-18-14/h8,14,16H,4-7,9-11H2,1-3H3.
What are the key properties of N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine?
N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine has a molecular weight of 266.38 g/mol, XLogP of 2.31, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-3-yl]methyl]ethanamine is sourced from PubChem (CID 62435009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).