1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine

C15H15F2NO — CID 63802154

IUPAC1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine
SMILESCC(N)Cc1ccc(Oc2cc(F)cc(F)c2)cc1
InChIInChI=1S/C15H15F2NO/c1-10(18)6-11-2-4-14(5-3-11)19-15-8-12(16)7-13(17)9-15/h2-5,7-10H,6,18H2,1H3
InChIKeyYUNSECTWJKUGKP-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.65
Rot. Bonds4

About 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine

1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine (PubChem CID 63802154) has the molecular formula C15H15F2NO and a molecular weight of 263.29 g/mol. Its IUPAC name is 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine.

Molecular Properties

Compound Name1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine
PubChem CID63802154
Molecular FormulaC15H15F2NO
Molecular Weight263.29 g/mol
Exact Mass263.11
IUPAC Name1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine
SMILESCC(N)Cc1ccc(Oc2cc(F)cc(F)c2)cc1
InChIInChI=1S/C15H15F2NO/c1-10(18)6-11-2-4-14(5-3-11)19-15-8-12(16)7-13(17)9-15/h2-5,7-10H,6,18H2,1H3
InChIKeyYUNSECTWJKUGKP-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-[4-(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-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine
CID 63943526
1-[4-(4-bromo-3,5-dimethylphenoxy)phenyl]propan-2-amine
CID 107726916
1-[4-[4-(4-chlorophenoxy)phenoxy]phenyl]propan-2-amine
CID 143625777
1-[4-(3-chlorophenoxy)phenyl]propan-2-amine
CID 63803972
1-[4-(4-butan-2-ylphenoxy)phenyl]propan-2-amine
CID 107668862
1-[4-(2,3-difluorophenoxy)phenyl]propan-2-amine
CID 63802336
(2R)-1-(3-fluoro-5-methoxyphenyl)propan-2-amine
CID 124510333
1-[4-(3-bromo-5-fluorophenoxy)-3-methylphenyl]propan-2-amine
CID 81326022
1-[4-(4-fluorophenoxy)-2-methylphenyl]propan-2-amine
CID 63801756
1-[6-(4-fluorophenoxy)-3-pyridinyl]propan-2-amine
CID 80640056
1,3,5-trifluoro-2-[4-(2-methylpropyl)phenoxy]benzene
CID 178142552
2-amino-3-[4-(3-fluorophenoxy)phenyl]propanoic acid
CID 146445500

Frequently Asked Questions

What is the IUPAC name of 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine?
The IUPAC name of 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine (CID 63802154) is 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine.
What is the SMILES notation for 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine?
The canonical SMILES for 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine is CC(N)Cc1ccc(Oc2cc(F)cc(F)c2)cc1.
What is the InChIKey of 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine?
The InChIKey is YUNSECTWJKUGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO/c1-10(18)6-11-2-4-14(5-3-11)19-15-8-12(16)7-13(17)9-15/h2-5,7-10H,6,18H2,1H3.
What are the key properties of 1-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine?
1-[4-(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-[4-(3,5-difluorophenoxy)phenyl]propan-2-amine is sourced from PubChem (CID 63802154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).