1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine

C15H15F2NO — CID 63943526

IUPAC1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine
SMILESCC(N)Cc1cccc(Oc2cc(F)cc(F)c2)c1
InChIInChI=1S/C15H15F2NO/c1-10(18)5-11-3-2-4-14(6-11)19-15-8-12(16)7-13(17)9-15/h2-4,6-10H,5,18H2,1H3
InChIKeyIZVVNOKLQZRIFJ-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.65
Rot. Bonds4

About 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine

1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine (PubChem CID 63943526) has the molecular formula C15H15F2NO and a molecular weight of 263.29 g/mol. Its IUPAC name is 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine.

Molecular Properties

Compound Name1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine
PubChem CID63943526
Molecular FormulaC15H15F2NO
Molecular Weight263.29 g/mol
Exact Mass263.11
IUPAC Name1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine
SMILESCC(N)Cc1cccc(Oc2cc(F)cc(F)c2)c1
InChIInChI=1S/C15H15F2NO/c1-10(18)5-11-3-2-4-14(6-11)19-15-8-12(16)7-13(17)9-15/h2-4,6-10H,5,18H2,1H3
InChIKeyIZVVNOKLQZRIFJ-UHFFFAOYSA-N
XLogP3.65
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-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-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine
CID 63802154
1-[3-(3,5-dimethoxyphenoxy)phenyl]propan-2-amine
CID 63941754
1-[3-(3-ethylphenoxy)phenyl]propan-2-amine
CID 63942734
1-[3-(3-bromo-4-fluorophenoxy)phenyl]propan-2-amine
CID 83234688
4-[3-(2-aminopropyl)phenoxy]aniline
CID 116996628
1-[3-(4-ethoxyphenoxy)phenyl]propan-2-amine
CID 63941952
1-(3-pyridin-3-yloxyphenyl)propan-2-amine
CID 63941950
1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine
CID 63943521
1-[3-(2,3-dihydro-1H-inden-5-yloxy)phenyl]propan-2-amine
CID 63942350
(2R)-1-(3-fluoro-5-methoxyphenyl)propan-2-amine
CID 124510333
1-[3-(2-methylpropoxy)phenyl]propan-2-amine
CID 60907864
1-[3-(methoxymethoxy)phenyl]propan-2-amine
CID 55253645

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine?
The IUPAC name of 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine (CID 63943526) is 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine.
What is the SMILES notation for 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine?
The canonical SMILES for 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine is CC(N)Cc1cccc(Oc2cc(F)cc(F)c2)c1.
What is the InChIKey of 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine?
The InChIKey is IZVVNOKLQZRIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO/c1-10(18)5-11-3-2-4-14(6-11)19-15-8-12(16)7-13(17)9-15/h2-4,6-10H,5,18H2,1H3.
What are the key properties of 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine?
1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine has a molecular weight of 263.29 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine is sourced from PubChem (CID 63943526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).