N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine

C14H20N2O2 — CID 62558930

IUPACN'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine
SMILESCCN(CCNCc1ccco1)Cc1ccco1
InChIInChI=1S/C14H20N2O2/c1-2-16(12-14-6-4-10-18-14)8-7-15-11-13-5-3-9-17-13/h3-6,9-10,15H,2,7-8,11-12H2,1H3
InChIKeyULTRXXYFSKKNGE-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.48
Rot. Bonds8

About N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine

N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine (PubChem CID 62558930) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine
PubChem CID62558930
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine
SMILESCCN(CCNCc1ccco1)Cc1ccco1
InChIInChI=1S/C14H20N2O2/c1-2-16(12-14-6-4-10-18-14)8-7-15-11-13-5-3-9-17-13/h3-6,9-10,15H,2,7-8,11-12H2,1H3
InChIKeyULTRXXYFSKKNGE-UHFFFAOYSA-N
XLogP2.48
TPSA41.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-ethyl-N'-(furan-2-ylmethyl)-N-(2-methylpropyl)ethane-1,2-diamine
CID 62463343
N'-ethyl-N'-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 62557722
N-(cyclopentylmethyl)-N'-ethyl-N'-(furan-2-ylmethyl)ethane-1,2-diamine
CID 62556677
N'-butan-2-yl-N'-ethyl-N-(furan-2-ylmethyl)ethane-1,2-diamine
CID 62559419
N'-ethyl-N'-(furan-2-ylmethyl)-N-(3-propan-2-yloxypropyl)ethane-1,2-diamine
CID 62558417
N'-ethyl-N'-(furan-2-ylmethyl)-N-(oxolan-2-ylmethyl)ethane-1,2-diamine
CID 62558243
N-(2-bromophenyl)-N'-ethyl-N'-(furan-2-ylmethyl)ethane-1,2-diamine
CID 55089120
N'-butan-2-yl-N-(furan-2-ylmethyl)-N'-methylethane-1,2-diamine
CID 62559417
N-[[4-[[ethyl(furan-2-ylmethyl)amino]methyl]phenyl]methyl]ethanamine
CID 62461578
N-tert-butyl-N'-ethyl-N'-(furan-2-ylmethyl)pentane-1,5-diamine
CID 55072248
N,N'-bis(furan-2-ylmethyl)pentane-1,5-diamine
CID 170781680
1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol
CID 61423764

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine (CID 62558930) is N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine is CCN(CCNCc1ccco1)Cc1ccco1.
What is the InChIKey of N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine?
The InChIKey is ULTRXXYFSKKNGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-16(12-14-6-4-10-18-14)8-7-15-11-13-5-3-9-17-13/h3-6,9-10,15H,2,7-8,11-12H2,1H3.
What are the key properties of N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine?
N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine has a molecular weight of 248.33 g/mol, XLogP of 2.48, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 62558930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).