1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine

C17H21FN2 — CID 105092665

IUPAC1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine
SMILESCCCNC(CCc1ccccn1)c1cccc(F)c1
InChIInChI=1S/C17H21FN2/c1-2-11-20-17(14-6-5-7-15(18)13-14)10-9-16-8-3-4-12-19-16/h3-8,12-13,17,20H,2,9-11H2,1H3
InChIKeyNGLVDEHVDHMELJ-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.89
Rot. Bonds7

About 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine

1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine (PubChem CID 105092665) has the molecular formula C17H21FN2 and a molecular weight of 272.37 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine
PubChem CID105092665
Molecular FormulaC17H21FN2
Molecular Weight272.37 g/mol
Exact Mass272.17
IUPAC Name1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine
SMILESCCCNC(CCc1ccccn1)c1cccc(F)c1
InChIInChI=1S/C17H21FN2/c1-2-11-20-17(14-6-5-7-15(18)13-14)10-9-16-8-3-4-12-19-16/h3-8,12-13,17,20H,2,9-11H2,1H3
InChIKeyNGLVDEHVDHMELJ-UHFFFAOYSA-N
XLogP3.89
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-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

1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105083650
1-(2,4-dimethylphenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105145212
N-[(3-fluorophenyl)-pyrimidin-2-ylmethyl]propan-1-amine
CID 60818747
4-ethylsulfonyl-1-(3-fluorophenyl)-N-propylbutan-1-amine
CID 65095394
1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105149718
1-(2-methylthiophen-3-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 102841379
2-[[3-(3-fluorophenyl)-3-(propylamino)propyl]-(2-hydroxyethyl)amino]ethanol
CID 62643290
N-[1-(4-chloro-3-fluorophenyl)-2-pyridin-2-ylethyl]propan-1-amine
CID 107989076
N-[1-(3,4-dimethylphenyl)-2-pyridin-2-ylethyl]propan-1-amine
CID 62550641
1-(2-fluorophenyl)-N-propyl-4-pyridin-2-ylbutan-2-amine
CID 105090087
N-[2-(2-bromophenyl)-1-(3-fluorophenyl)ethyl]propan-1-amine
CID 60819665
N-[1-(3-fluorophenyl)-2-(1-methylpyrazol-3-yl)ethyl]propan-1-amine
CID 82877484

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine?
The IUPAC name of 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine (CID 105092665) is 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine is CCCNC(CCc1ccccn1)c1cccc(F)c1.
What is the InChIKey of 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine?
The InChIKey is NGLVDEHVDHMELJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2/c1-2-11-20-17(14-6-5-7-15(18)13-14)10-9-16-8-3-4-12-19-16/h3-8,12-13,17,20H,2,9-11H2,1H3.
What are the key properties of 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine?
1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine has a molecular weight of 272.37 g/mol, XLogP of 3.89, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 105092665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).