1-(3,4-difluorophenyl)-2-phenylpropan-2-amine

C15H15F2N — CID 82919895

IUPAC1-(3,4-difluorophenyl)-2-phenylpropan-2-amine
SMILESCC(N)(Cc1ccc(F)c(F)c1)c1ccccc1
InChIInChI=1S/C15H15F2N/c1-15(18,12-5-3-2-4-6-12)10-11-7-8-13(16)14(17)9-11/h2-9H,10,18H2,1H3
InChIKeyKXMVBXCTJPROHR-UHFFFAOYSA-N
MW247.29 g/mol
LogP3.38
Rot. Bonds3

About 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine

1-(3,4-difluorophenyl)-2-phenylpropan-2-amine (PubChem CID 82919895) has the molecular formula C15H15F2N and a molecular weight of 247.29 g/mol. Its IUPAC name is 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine.

Molecular Properties

Compound Name1-(3,4-difluorophenyl)-2-phenylpropan-2-amine
PubChem CID82919895
Molecular FormulaC15H15F2N
Molecular Weight247.29 g/mol
Exact Mass247.12
IUPAC Name1-(3,4-difluorophenyl)-2-phenylpropan-2-amine
SMILESCC(N)(Cc1ccc(F)c(F)c1)c1ccccc1
InChIInChI=1S/C15H15F2N/c1-15(18,12-5-3-2-4-6-12)10-11-7-8-13(16)14(17)9-11/h2-9H,10,18H2,1H3
InChIKeyKXMVBXCTJPROHR-UHFFFAOYSA-N
XLogP3.38
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,4-difluorophenyl)-2-(3-fluorophenyl)propan-2-amine
CID 82920377
1-[3-(2-amino-2-phenylpropyl)phenyl]-2-phenylpropan-2-amine
CID 175440072
1-(5-chloro-2-fluorophenyl)-2-phenylpropan-2-amine
CID 103047839
2-benzyl-1-(3,4-difluorophenyl)butan-2-amine
CID 82920189
1-(5-bromo-2-fluorophenyl)-2-phenylpropan-2-amine
CID 55096060
1-(3,4-difluorophenyl)-2-N',2-N'-dimethylpropane-2,2-diamine
CID 84752735
1-(3,4-difluorophenyl)-3-methoxy-2-phenylpropan-2-ol
CID 103465180
1,2-bis(3-fluorophenyl)propan-2-amine
CID 60799225
1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)propan-2-amine
CID 62621995
2-(3-fluorophenyl)-1-(4-fluorophenyl)propan-2-amine
CID 60798625
2-(3-chlorophenyl)-1-(3,4-difluorophenyl)propan-2-ol
CID 82919978
1-(3-bromo-4-fluorophenyl)-2-(2-bromophenyl)propan-2-amine
CID 63408536

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine?
The IUPAC name of 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine (CID 82919895) is 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine.
What is the SMILES notation for 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine?
The canonical SMILES for 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine is CC(N)(Cc1ccc(F)c(F)c1)c1ccccc1.
What is the InChIKey of 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine?
The InChIKey is KXMVBXCTJPROHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N/c1-15(18,12-5-3-2-4-6-12)10-11-7-8-13(16)14(17)9-11/h2-9H,10,18H2,1H3.
What are the key properties of 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine?
1-(3,4-difluorophenyl)-2-phenylpropan-2-amine has a molecular weight of 247.29 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-difluorophenyl)-2-phenylpropan-2-amine is sourced from PubChem (CID 82919895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).