N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine

C15H22N2O2 — CID 62420998

IUPACN-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ccoc1CN(C)Cc1ccco1
InChIInChI=1S/C15H22N2O2/c1-12(2)16-9-13-6-8-19-15(13)11-17(3)10-14-5-4-7-18-14/h4-8,12,16H,9-11H2,1-3H3
InChIKeyUHUXUKWALCLIJP-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.00
Rot. Bonds7

About N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine

N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine (PubChem CID 62420998) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine
PubChem CID62420998
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ccoc1CN(C)Cc1ccco1
InChIInChI=1S/C15H22N2O2/c1-12(2)16-9-13-6-8-19-15(13)11-17(3)10-14-5-4-7-18-14/h4-8,12,16H,9-11H2,1-3H3
InChIKeyUHUXUKWALCLIJP-UHFFFAOYSA-N
XLogP3.00
TPSA41.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine (CID 62420998) is N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine is CC(C)NCc1ccoc1CN(C)Cc1ccco1.
What is the InChIKey of N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine?
The InChIKey is UHUXUKWALCLIJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12(2)16-9-13-6-8-19-15(13)11-17(3)10-14-5-4-7-18-14/h4-8,12,16H,9-11H2,1-3H3.
What are the key properties of N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine?
N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine has a molecular weight of 262.35 g/mol, XLogP of 3.00, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[[furan-2-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 62420998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).