3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine

C17H20FN — CID 170865955

IUPAC3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine
SMILESCN(C)CCCc1ccccc1-c1ccccc1F
InChIInChI=1S/C17H20FN/c1-19(2)13-7-9-14-8-3-4-10-15(14)16-11-5-6-12-17(16)18/h3-6,8,10-12H,7,9,13H2,1-2H3
InChIKeyPGJNWMNTJDIDCF-UHFFFAOYSA-N
MW257.35 g/mol
LogP3.99
Rot. Bonds5

About 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine

3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine (PubChem CID 170865955) has the molecular formula C17H20FN and a molecular weight of 257.35 g/mol. Its IUPAC name is 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine
PubChem CID170865955
Molecular FormulaC17H20FN
Molecular Weight257.35 g/mol
Exact Mass257.16
IUPAC Name3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine
SMILESCN(C)CCCc1ccccc1-c1ccccc1F
InChIInChI=1S/C17H20FN/c1-19(2)13-7-9-14-8-3-4-10-15(14)16-11-5-6-12-17(16)18/h3-6,8,10-12H,7,9,13H2,1-2H3
InChIKeyPGJNWMNTJDIDCF-UHFFFAOYSA-N
XLogP3.99
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.35
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-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

3-[2-(2-fluorophenyl)phenyl]propan-1-amine
CID 170878786
1-fluoro-2-(2-propylphenyl)benzene
CID 154059621
N,N-dimethyl-3-(2-thiophen-3-ylphenyl)propan-1-amine
CID 170865988
3-[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-N,N-dimethylpropan-1-amine
CID 170865688
2-[3-(dimethylamino)propyl]benzonitrile
CID 10702796
N-[3-(dimethylamino)propyl]-4-(2-fluorophenyl)butanamide
CID 110408284
4-[3-[2-(2-fluorophenyl)phenyl]propyl]morpholine
CID 170869953
N,N-dimethyl-12-(2-methylphenyl)dodecan-1-amine;hydrate
CID 173447859
1-[3-(dimethylamino)propyl]-3-[2-(2-fluorophenyl)ethyl]-2-methylguanidine;hydroiodide
CID 111361404
1-[2-(2-fluorophenyl)phenyl]propan-2-amine
CID 170864653
3-[[5-(2-fluorophenyl)-2-pyridinyl]oxy]-N,N-dimethylpropan-1-amine
CID 126471087
3-[3-(dimethylamino)propylamino]-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 109017050

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine (CID 170865955) is 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine is CN(C)CCCc1ccccc1-c1ccccc1F.
What is the InChIKey of 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine?
The InChIKey is PGJNWMNTJDIDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FN/c1-19(2)13-7-9-14-8-3-4-10-15(14)16-11-5-6-12-17(16)18/h3-6,8,10-12H,7,9,13H2,1-2H3.
What are the key properties of 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine?
3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine has a molecular weight of 257.35 g/mol, XLogP of 3.99, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-fluorophenyl)phenyl]-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 170865955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).