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

C15H26N2O2 — CID 62258177

IUPACN-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine
SMILESCCNCC1(CN(C)Cc2ccc(C)o2)CCOC1
InChIInChI=1S/C15H26N2O2/c1-4-16-10-15(7-8-18-12-15)11-17(3)9-14-6-5-13(2)19-14/h5-6,16H,4,7-12H2,1-3H3
InChIKeyKCQFPISTYWMEPL-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.04
Rot. Bonds7

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

N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine (PubChem CID 62258177) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine
PubChem CID62258177
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine
SMILESCCNCC1(CN(C)Cc2ccc(C)o2)CCOC1
InChIInChI=1S/C15H26N2O2/c1-4-16-10-15(7-8-18-12-15)11-17(3)9-14-6-5-13(2)19-14/h5-6,16H,4,7-12H2,1-3H3
InChIKeyKCQFPISTYWMEPL-UHFFFAOYSA-N
XLogP2.04
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 ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine (CID 62258177) is N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine is CCNCC1(CN(C)Cc2ccc(C)o2)CCOC1.
What is the InChIKey of N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine?
The InChIKey is KCQFPISTYWMEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-4-16-10-15(7-8-18-12-15)11-17(3)9-14-6-5-13(2)19-14/h5-6,16H,4,7-12H2,1-3H3.
What are the key properties of N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine?
N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine has a molecular weight of 266.38 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-3-yl]methyl]ethanamine is sourced from PubChem (CID 62258177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).