3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine

C15H14Cl2FN — CID 102619974

IUPAC3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine
SMILESNCC(Cc1cc(F)ccc1Cl)c1ccccc1Cl
InChIInChI=1S/C15H14Cl2FN/c16-14-6-5-12(18)8-10(14)7-11(9-19)13-3-1-2-4-15(13)17/h1-6,8,11H,7,9,19H2
InChIKeyIYEUYQLCZXICAA-UHFFFAOYSA-N
MW298.19 g/mol
LogP4.42
Rot. Bonds4

About 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine

3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine (PubChem CID 102619974) has the molecular formula C15H14Cl2FN and a molecular weight of 298.19 g/mol. Its IUPAC name is 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine.

Molecular Properties

Compound Name3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine
PubChem CID102619974
Molecular FormulaC15H14Cl2FN
Molecular Weight298.19 g/mol
Exact Mass297.05
IUPAC Name3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine
SMILESNCC(Cc1cc(F)ccc1Cl)c1ccccc1Cl
InChIInChI=1S/C15H14Cl2FN/c16-14-6-5-12(18)8-10(14)7-11(9-19)13-3-1-2-4-15(13)17/h1-6,8,11H,7,9,19H2
InChIKeyIYEUYQLCZXICAA-UHFFFAOYSA-N
XLogP4.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.19
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine
CID 102618794
2-(2-chlorophenyl)-3-(2,4-dichlorophenyl)propan-1-amine
CID 79448884
2-(2-chloro-5-fluorophenyl)-3-fluoropropan-1-amine
CID 83819971
3-(2-chloro-5-fluorophenyl)-2-(4-methylphenyl)propan-1-amine
CID 102619951
3-(3-chloro-4-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine
CID 103041153
2-chloro-1-[3-chloro-2-(2-chlorophenyl)propyl]-4-fluorobenzene
CID 79455239
2-(2-chloro-5-fluorophenyl)-1-[2-(trifluoromethyl)phenyl]ethanamine
CID 102622579
2-(2-chloro-5-fluorophenyl)-1-(2-methylsulfanylphenyl)ethanamine
CID 102622535
1,4-dichloro-2-[3-chloro-2-(2-chlorophenyl)propyl]benzene
CID 79455159
1-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)ethanamine
CID 105394821
3-(2,4-difluorophenyl)-2-(2-methylphenyl)propan-1-amine
CID 79421165
2-(2-chloro-5-fluorophenyl)-1-naphthalen-1-ylethanol
CID 102617231

Frequently Asked Questions

What is the IUPAC name of 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine?
The IUPAC name of 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine (CID 102619974) is 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine.
What is the SMILES notation for 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine?
The canonical SMILES for 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine is NCC(Cc1cc(F)ccc1Cl)c1ccccc1Cl.
What is the InChIKey of 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine?
The InChIKey is IYEUYQLCZXICAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2FN/c16-14-6-5-12(18)8-10(14)7-11(9-19)13-3-1-2-4-15(13)17/h1-6,8,11H,7,9,19H2.
What are the key properties of 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine?
3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine has a molecular weight of 298.19 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine is sourced from PubChem (CID 102619974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).