N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine

C11H20N2O — CID 62419344

IUPACN-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine
SMILESCCN(Cc1ccoc1CN)C(C)C
InChIInChI=1S/C11H20N2O/c1-4-13(9(2)3)8-10-5-6-14-11(10)7-12/h5-6,9H,4,7-8,12H2,1-3H3
InChIKeyVVSYCVMTRMKESJ-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.97
Rot. Bonds5

About N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine

N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine (PubChem CID 62419344) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine
PubChem CID62419344
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine
SMILESCCN(Cc1ccoc1CN)C(C)C
InChIInChI=1S/C11H20N2O/c1-4-13(9(2)3)8-10-5-6-14-11(10)7-12/h5-6,9H,4,7-8,12H2,1-3H3
InChIKeyVVSYCVMTRMKESJ-UHFFFAOYSA-N
XLogP1.97
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-[[3-(methylaminomethyl)furan-2-yl]methyl]propan-2-amine
CID 62418170
N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethyl-2-fluoroaniline
CID 62428968
N'-[[2-(aminomethyl)furan-3-yl]methyl]-N,N,N'-trimethylethane-1,2-diamine
CID 63725121
N-[[2-[(tert-butylamino)methyl]furan-3-yl]methyl]-N-ethylbutan-2-amine
CID 62420329
N-[[3-(aminomethyl)furan-2-yl]methyl]-N-methylbutan-2-amine
CID 62419080
2-methyl-N-[[3-[[propan-2-yl(propyl)amino]methyl]furan-2-yl]methyl]propan-2-amine
CID 55075072
N-[[2-(methylaminomethyl)furan-3-yl]methyl]-N-propan-2-ylpentan-1-amine
CID 55072134
[3-[[(4-methoxyphenyl)methyl-methylamino]methyl]furan-2-yl]methanamine
CID 62436265
[2-(2-methylpropyl)furan-3-yl]methanamine
CID 82416814
N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine
CID 62422966
2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine
CID 62426254
N-[[3-(aminomethyl)furan-2-yl]methyl]-N-ethylcyclopropanamine
CID 62420146

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine?
The IUPAC name of N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine (CID 62419344) is N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine.
What is the SMILES notation for N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine?
The canonical SMILES for N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine is CCN(Cc1ccoc1CN)C(C)C.
What is the InChIKey of N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine?
The InChIKey is VVSYCVMTRMKESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-4-13(9(2)3)8-10-5-6-14-11(10)7-12/h5-6,9H,4,7-8,12H2,1-3H3.
What are the key properties of N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine?
N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine has a molecular weight of 196.29 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethylpropan-2-amine is sourced from PubChem (CID 62419344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).