2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride

C17H20ClFN2O2 — CID 67125309

IUPAC2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride
SMILESCC(NCc1ccc(OCc2ccccc2F)cc1)C(N)=O.Cl
InChIInChI=1S/C17H19FN2O2.ClH/c1-12(17(19)21)20-10-13-6-8-15(9-7-13)22-11-14-4-2-3-5-16(14)18;/h2-9,12,20H,10-11H2,1H3,(H2,19,21);1H
InChIKeyBWZBOEFXTMOULJ-UHFFFAOYSA-N
MW338.81 g/mol
LogP2.79
Rot. Bonds7

About 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride

2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride (PubChem CID 67125309) has the molecular formula C17H20ClFN2O2 and a molecular weight of 338.81 g/mol. Its IUPAC name is 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride.

Molecular Properties

Compound Name2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride
PubChem CID67125309
Molecular FormulaC17H20ClFN2O2
Molecular Weight338.81 g/mol
Exact Mass338.12
IUPAC Name2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride
SMILESCC(NCc1ccc(OCc2ccccc2F)cc1)C(N)=O.Cl
InChIInChI=1S/C17H19FN2O2.ClH/c1-12(17(19)21)20-10-13-6-8-15(9-7-13)22-11-14-4-2-3-5-16(14)18;/h2-9,12,20H,10-11H2,1H3,(H2,19,21);1H
InChIKeyBWZBOEFXTMOULJ-UHFFFAOYSA-N
XLogP2.79
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.81
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride 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

bis((2S)-2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide);methanesulfonic acid;hydrate
CID 54596588
2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-N-methylpropanamide
CID 10064347
(2S)-2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-3-hydroxy-N,N-dimethylpropanamide
CID 54327325
(2S)-2-[[4-(2-amino-2-oxoethoxy)phenyl]methylamino]propanamide
CID 39756608
(2S)-2-[[3-[(2-fluorophenyl)methoxy]-1,2-oxazol-5-yl]methylamino]propanamide
CID 67670217
(2S)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]propanamide;methanesulfonic acid
CID 3038502
(2S)-2-[[4-[(4-nitrophenyl)methoxy]phenyl]methylamino]propanamide
CID 23625206
6-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]pyridazine-3-carboxamide
CID 133477298
(2R)-2-[(4-pentoxyphenyl)methylamino]propanamide
CID 93037212
3-[[4-[(2-fluorophenyl)methoxy]phenyl]methylcarbamoyl-methylamino]-2-methylpropanoic acid
CID 122010216
(2S)-2-[[4-(1-phenylethoxy)phenyl]methylamino]propanamide
CID 70078273
(2S)-2-[[4-(cyclopropylmethoxy)phenyl]methylamino]propanamide
CID 10490793

Frequently Asked Questions

What is the IUPAC name of 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride?
The IUPAC name of 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride (CID 67125309) is 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride.
What is the SMILES notation for 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride?
The canonical SMILES for 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride is CC(NCc1ccc(OCc2ccccc2F)cc1)C(N)=O.Cl.
What is the InChIKey of 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride?
The InChIKey is BWZBOEFXTMOULJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O2.ClH/c1-12(17(19)21)20-10-13-6-8-15(9-7-13)22-11-14-4-2-3-5-16(14)18;/h2-9,12,20H,10-11H2,1H3,(H2,19,21);1H.
What are the key properties of 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride?
2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride has a molecular weight of 338.81 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]propanamide;hydrochloride is sourced from PubChem (CID 67125309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).