2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine

C15H18FNO — CID 63000314

IUPAC2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine
SMILESCNCC(Cc1ccco1)Cc1ccccc1F
InChIInChI=1S/C15H18FNO/c1-17-11-12(10-14-6-4-8-18-14)9-13-5-2-3-7-15(13)16/h2-8,12,17H,9-11H2,1H3
InChIKeyZSXWRYKVYJGSAQ-UHFFFAOYSA-N
MW247.31 g/mol
LogP3.04
Rot. Bonds6

About 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine

2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine (PubChem CID 63000314) has the molecular formula C15H18FNO and a molecular weight of 247.31 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine
PubChem CID63000314
Molecular FormulaC15H18FNO
Molecular Weight247.31 g/mol
Exact Mass247.14
IUPAC Name2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine
SMILESCNCC(Cc1ccco1)Cc1ccccc1F
InChIInChI=1S/C15H18FNO/c1-17-11-12(10-14-6-4-8-18-14)9-13-5-2-3-7-15(13)16/h2-8,12,17H,9-11H2,1H3
InChIKeyZSXWRYKVYJGSAQ-UHFFFAOYSA-N
XLogP3.04
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.31
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine 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

2-(furan-2-ylmethyl)-N-methylbutan-1-amine
CID 62998864
[1-(2-fluorophenyl)-3-(furan-2-yl)propan-2-yl]hydrazine
CID 105206963
1-(2-fluorophenyl)-4-(furan-2-yl)-N-methylbutan-2-amine
CID 61066306
2-[(2-chloro-6-fluorophenyl)methyl]-3-(2-fluorophenyl)-N-methylpropan-1-amine
CID 62514397
2-[(2,5-dimethylphenyl)methyl]-3-(2-fluorophenyl)-N-methylpropan-1-amine
CID 62516825
2-[(2-fluorophenyl)methyl]-N-methyl-5-phenylpentan-1-amine
CID 62514753
1-(2-fluorophenyl)-3-(methylamino)propan-2-ol
CID 64989565
2-[(2-fluorophenyl)methyl]-N-methyl-4-propoxybutan-1-amine
CID 106456725
1-(2-ethylbutyl)-2-fluorobenzene
CID 139973427
2-(2-ethylbutyl)furan
CID 68844643
2-[(2-bromophenyl)methyl]-3-(5-chloro-2-fluorophenyl)-N-methylpropan-1-amine
CID 103049663
2-(2-fluorophenyl)-3-(furan-2-yl)-N-propan-2-ylpropan-1-amine
CID 79439686

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine?
The IUPAC name of 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine (CID 63000314) is 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine?
The canonical SMILES for 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine is CNCC(Cc1ccco1)Cc1ccccc1F.
What is the InChIKey of 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine?
The InChIKey is ZSXWRYKVYJGSAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO/c1-17-11-12(10-14-6-4-8-18-14)9-13-5-2-3-7-15(13)16/h2-8,12,17H,9-11H2,1H3.
What are the key properties of 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine?
2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine has a molecular weight of 247.31 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methyl]-3-(furan-2-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 63000314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).