N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine

C14H26N2O — CID 62461555

IUPACN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine
SMILESCCNCc1ccc(CN(C)CC(C)(C)C)o1
InChIInChI=1S/C14H26N2O/c1-6-15-9-12-7-8-13(17-12)10-16(5)11-14(2,3)4/h7-8,15H,6,9-11H2,1-5H3
InChIKeyNGWZREHBQUCIDJ-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.87
Rot. Bonds6

About N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine

N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine (PubChem CID 62461555) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine.

Molecular Properties

Compound NameN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine
PubChem CID62461555
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine
SMILESCCNCc1ccc(CN(C)CC(C)(C)C)o1
InChIInChI=1S/C14H26N2O/c1-6-15-9-12-7-8-13(17-12)10-16(5)11-14(2,3)4/h7-8,15H,6,9-11H2,1-5H3
InChIKeyNGWZREHBQUCIDJ-UHFFFAOYSA-N
XLogP2.87
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-[[(4-chlorophenyl)methyl-methylamino]methyl]furan-2-yl]methyl]ethanamine
CID 62412356
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine
CID 62424825
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,4-dimethylpentan-2-amine
CID 62461260
N-[[5-[[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]methyl]furan-2-yl]methyl]ethanamine
CID 55256758
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylcycloheptanamine
CID 62434036
N-[[5-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]furan-2-yl]methyl]ethanamine
CID 79312711
N-ethyl-N',2-dimethyl-N'-[(5-methylfuran-2-yl)methyl]-2-propylpropane-1,3-diamine
CID 62255914
2-methyl-1-[methyl-[(5-methylfuran-2-yl)methyl]amino]propan-2-ol
CID 60886966
N-[[4-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]phenyl]methyl]ethanamine
CID 62422093
N,2-diethyl-N-[[5-(ethylaminomethyl)furan-2-yl]methyl]butan-1-amine
CID 62435355
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,3-dimethylcyclohexan-1-amine
CID 55073598
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylaniline
CID 62430923

Frequently Asked Questions

What is the IUPAC name of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine?
The IUPAC name of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine (CID 62461555) is N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine.
What is the SMILES notation for N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine?
The canonical SMILES for N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine is CCNCc1ccc(CN(C)CC(C)(C)C)o1.
What is the InChIKey of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine?
The InChIKey is NGWZREHBQUCIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-6-15-9-12-7-8-13(17-12)10-16(5)11-14(2,3)4/h7-8,15H,6,9-11H2,1-5H3.
What are the key properties of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine?
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine has a molecular weight of 238.37 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine is sourced from PubChem (CID 62461555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).