1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine

C14H11Cl2F2N — CID 102866438

IUPAC1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
SMILESNC(Cc1cccc(Cl)c1F)c1cccc(F)c1Cl
InChIInChI=1S/C14H11Cl2F2N/c15-10-5-1-3-8(14(10)18)7-12(19)9-4-2-6-11(17)13(9)16/h1-6,12H,7,19H2
InChIKeyFBDJDZGJEOJDFB-UHFFFAOYSA-N
MW302.15 g/mol
LogP4.51
Rot. Bonds3

About 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine

1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine (PubChem CID 102866438) has the molecular formula C14H11Cl2F2N and a molecular weight of 302.15 g/mol. Its IUPAC name is 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
PubChem CID102866438
Molecular FormulaC14H11Cl2F2N
Molecular Weight302.15 g/mol
Exact Mass301.02
IUPAC Name1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
SMILESNC(Cc1cccc(Cl)c1F)c1cccc(F)c1Cl
InChIInChI=1S/C14H11Cl2F2N/c15-10-5-1-3-8(14(10)18)7-12(19)9-4-2-6-11(17)13(9)16/h1-6,12H,7,19H2
InChIKeyFBDJDZGJEOJDFB-UHFFFAOYSA-N
XLogP4.51
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.15
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-bromo-2-chlorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
CID 102866631
1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
CID 64713277
2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 105032385
2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine
CID 102858038
2-(3-chloro-2-fluorophenyl)-1-(2,3,4-trifluorophenyl)ethanamine
CID 82806473
1-(4-bromophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
CID 102857503
(1S)-1-(2-chloro-3-fluorophenyl)propane-1,3-diamine
CID 171222588
2-(3-chloro-2-fluorophenyl)-1-(4-chloro-3-fluorophenyl)ethanamine
CID 107995788
1-(2-chloro-3-fluorophenyl)-2-(3,4-dichlorophenyl)ethanamine
CID 81454060
2-(5-bromo-2-fluorophenyl)-1-(2,3-dichlorophenyl)ethanamine
CID 115839801
1-(3-chloro-2-fluorophenyl)-3-(2,3-difluorophenyl)propan-2-ol
CID 82806467
2-(3-chloro-2-fluorophenyl)-1-(2-fluorophenyl)ethanol
CID 82802842

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine?
The IUPAC name of 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine (CID 102866438) is 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine.
What is the SMILES notation for 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine?
The canonical SMILES for 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine is NC(Cc1cccc(Cl)c1F)c1cccc(F)c1Cl.
What is the InChIKey of 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine?
The InChIKey is FBDJDZGJEOJDFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2F2N/c15-10-5-1-3-8(14(10)18)7-12(19)9-4-2-6-11(17)13(9)16/h1-6,12H,7,19H2.
What are the key properties of 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine?
1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine has a molecular weight of 302.15 g/mol, XLogP of 4.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine is sourced from PubChem (CID 102866438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).