2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine

C14H11Cl2F2N — CID 102858038

IUPAC2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine
SMILESNC(Cc1cccc(Cl)c1F)c1cc(Cl)ccc1F
InChIInChI=1S/C14H11Cl2F2N/c15-9-4-5-12(17)10(7-9)13(19)6-8-2-1-3-11(16)14(8)18/h1-5,7,13H,6,19H2
InChIKeyPRVLFRHPFMHNLM-UHFFFAOYSA-N
MW302.15 g/mol
LogP4.51
Rot. Bonds3

About 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine

2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine (PubChem CID 102858038) has the molecular formula C14H11Cl2F2N and a molecular weight of 302.15 g/mol. Its IUPAC name is 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine
PubChem CID102858038
Molecular FormulaC14H11Cl2F2N
Molecular Weight302.15 g/mol
Exact Mass301.02
IUPAC Name2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine
SMILESNC(Cc1cccc(Cl)c1F)c1cc(Cl)ccc1F
InChIInChI=1S/C14H11Cl2F2N/c15-9-4-5-12(17)10(7-9)13(19)6-8-2-1-3-11(16)14(8)18/h1-5,7,13H,6,19H2
InChIKeyPRVLFRHPFMHNLM-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

2-(3-chloro-2-fluorophenyl)-1-(2,3,4-trifluorophenyl)ethanamine
CID 82806473
1-(5-chloro-2-fluorophenyl)-2-(2,5-dichlorophenyl)ethanamine
CID 114885921
1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
CID 102866438
2-(2-chlorophenyl)-1-(2,5-difluorophenyl)ethanamine
CID 43197901
2-(3-chloro-2-fluorophenyl)-1-(4-chloro-3-fluorophenyl)ethanamine
CID 107995788
1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
CID 64713277
1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanamine
CID 64714150
1-(5-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanamine
CID 114885798
1-(3-bromo-2-chlorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
CID 102866631
2-(2,4-dichlorophenyl)-1-(2-fluorophenyl)ethanamine
CID 62502807
1-(4-chloro-2,5-difluorophenyl)-2-(2-chlorophenyl)ethanamine
CID 82773222
[2-(3-chloro-2-fluorophenyl)-1-(2,5-difluorophenyl)ethyl]hydrazine
CID 105264375

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine?
The IUPAC name of 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine (CID 102858038) is 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine?
The canonical SMILES for 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine is NC(Cc1cccc(Cl)c1F)c1cc(Cl)ccc1F.
What is the InChIKey of 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine?
The InChIKey is PRVLFRHPFMHNLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2F2N/c15-9-4-5-12(17)10(7-9)13(19)6-8-2-1-3-11(16)14(8)18/h1-5,7,13H,6,19H2.
What are the key properties of 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine?
2-(3-chloro-2-fluorophenyl)-1-(5-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 2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine is sourced from PubChem (CID 102858038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).