N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine

C12H22N2O — CID 62424825

IUPACN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine
SMILESCCNCc1ccc(CN(C)C(C)C)o1
InChIInChI=1S/C12H22N2O/c1-5-13-8-11-6-7-12(15-11)9-14(4)10(2)3/h6-7,10,13H,5,8-9H2,1-4H3
InChIKeyFKJDUEZKWBCOBC-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.23
Rot. Bonds6

About N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine

N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine (PubChem CID 62424825) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine
PubChem CID62424825
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine
SMILESCCNCc1ccc(CN(C)C(C)C)o1
InChIInChI=1S/C12H22N2O/c1-5-13-8-11-6-7-12(15-11)9-14(4)10(2)3/h6-7,10,13H,5,8-9H2,1-4H3
InChIKeyFKJDUEZKWBCOBC-UHFFFAOYSA-N
XLogP2.23
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,4-dimethylpentan-2-amine
CID 62461260
1-(2-chlorophenyl)-N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylethanamine
CID 62983851
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,2,2-trimethylpropan-1-amine
CID 62461555
N-ethyl-N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-1-methoxypropan-2-amine
CID 62427043
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylcycloheptanamine
CID 62434036
N,2-diethyl-N-[[5-(ethylaminomethyl)furan-2-yl]methyl]butan-1-amine
CID 62435355
N,3,3-trimethyl-N-[[5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]butan-2-amine
CID 62426314
N-[[5-[[(4-chlorophenyl)methyl-methylamino]methyl]furan-2-yl]methyl]ethanamine
CID 62412356
N-[[5-[(tert-butylamino)methyl]furan-2-yl]methyl]-N-methylbutan-2-amine
CID 62418488
N-[[5-[[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]methyl]furan-2-yl]methyl]ethanamine
CID 55256758
N,3-dimethyl-N-[[5-[(propan-2-ylamino)methyl]furan-2-yl]methyl]butan-2-amine
CID 62432829
N-[[3-(ethylaminomethyl)phenyl]methyl]-N-methylpropan-2-amine
CID 62423900

Frequently Asked Questions

What is the IUPAC name of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine?
The IUPAC name of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine (CID 62424825) is N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine.
What is the SMILES notation for N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine?
The canonical SMILES for N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine is CCNCc1ccc(CN(C)C(C)C)o1.
What is the InChIKey of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine?
The InChIKey is FKJDUEZKWBCOBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-5-13-8-11-6-7-12(15-11)9-14(4)10(2)3/h6-7,10,13H,5,8-9H2,1-4H3.
What are the key properties of N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine?
N-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpropan-2-amine has a molecular weight of 210.32 g/mol, XLogP of 2.23, 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-methylpropan-2-amine is sourced from PubChem (CID 62424825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).