3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline

C14H17FN2O — CID 62435483

IUPAC3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline
SMILESCNCc1ccc(CN(C)c2cccc(F)c2)o1
InChIInChI=1S/C14H17FN2O/c1-16-9-13-6-7-14(18-13)10-17(2)12-5-3-4-11(15)8-12/h3-8,16H,9-10H2,1-2H3
InChIKeyFSWIAIMGGDQJGU-UHFFFAOYSA-N
MW248.30 g/mol
LogP2.77
Rot. Bonds5

About 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline

3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline (PubChem CID 62435483) has the molecular formula C14H17FN2O and a molecular weight of 248.30 g/mol. Its IUPAC name is 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline.

Molecular Properties

Compound Name3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline
PubChem CID62435483
Molecular FormulaC14H17FN2O
Molecular Weight248.30 g/mol
Exact Mass248.13
IUPAC Name3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline
SMILESCNCc1ccc(CN(C)c2cccc(F)c2)o1
InChIInChI=1S/C14H17FN2O/c1-16-9-13-6-7-14(18-13)10-17(2)12-5-3-4-11(15)8-12/h3-8,16H,9-10H2,1-2H3
InChIKeyFSWIAIMGGDQJGU-UHFFFAOYSA-N
XLogP2.77
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(3-fluoro-N-methylanilino)methyl]furan-2-carbohydrazide
CID 63583297
3-fluoro-N-[[2-methoxy-5-(methylaminomethyl)phenyl]methyl]-N-methylaniline
CID 62019120
3-fluoro-N-methyl-N-[[3-(propylaminomethyl)-1,2-oxazol-5-yl]methyl]aniline
CID 62461087
N-ethyl-3-fluoro-N-[[5-methyl-4-(methylaminomethyl)furan-2-yl]methyl]aniline
CID 62428658
6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine
CID 79243204
5-[(3-fluoro-N-methylanilino)methyl]-N-methyl-1,3,4-thiadiazol-2-amine
CID 80606202
N-(chloromethyl)-3-fluoro-N-methylaniline
CID 115262926
3-fluoro-N-methyl-N-[[5-(propylaminomethyl)thiophen-2-yl]methyl]aniline
CID 107556467
N-[[5-[[(3-fluorophenyl)methyl-methylamino]methyl]furan-2-yl]methyl]propan-1-amine
CID 62419238
3-fluoro-N-methyl-N-[[2-[(propan-2-ylamino)methyl]phenyl]methyl]aniline
CID 62461622
N,3-dimethyl-4-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]aniline
CID 62135016
N-[[2-(ethylaminomethyl)furan-3-yl]methyl]-3-fluoro-N-methylaniline
CID 62435493

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline?
The IUPAC name of 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline (CID 62435483) is 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline.
What is the SMILES notation for 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline?
The canonical SMILES for 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline is CNCc1ccc(CN(C)c2cccc(F)c2)o1.
What is the InChIKey of 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline?
The InChIKey is FSWIAIMGGDQJGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O/c1-16-9-13-6-7-14(18-13)10-17(2)12-5-3-4-11(15)8-12/h3-8,16H,9-10H2,1-2H3.
What are the key properties of 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline?
3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline has a molecular weight of 248.30 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline is sourced from PubChem (CID 62435483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).