(2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine

C13H9Cl2F2N — CID 43197833

IUPAC(2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine
SMILESNC(c1cc(F)ccc1F)c1c(Cl)cccc1Cl
InChIInChI=1S/C13H9Cl2F2N/c14-9-2-1-3-10(15)12(9)13(18)8-6-7(16)4-5-11(8)17/h1-6,13H,18H2
InChIKeyLVUZNICCRPZGMU-UHFFFAOYSA-N
MW288.12 g/mol
LogP4.32
Rot. Bonds2

About (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine

(2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine (PubChem CID 43197833) has the molecular formula C13H9Cl2F2N and a molecular weight of 288.12 g/mol. Its IUPAC name is (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine.

Molecular Properties

Compound Name(2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine
PubChem CID43197833
Molecular FormulaC13H9Cl2F2N
Molecular Weight288.12 g/mol
Exact Mass287.01
IUPAC Name(2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine
SMILESNC(c1cc(F)ccc1F)c1c(Cl)cccc1Cl
InChIInChI=1S/C13H9Cl2F2N/c14-9-2-1-3-10(15)12(9)13(18)8-6-7(16)4-5-11(8)17/h1-6,13H,18H2
InChIKeyLVUZNICCRPZGMU-UHFFFAOYSA-N
XLogP4.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.12
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,4-dichlorophenyl)-(2,5-difluorophenyl)methanamine
CID 43197872
1-(2-chloro-6-fluorophenyl)-1-(2,5-difluorophenyl)-N-methylmethanamine
CID 43482973
(5-chloro-2-fluorophenyl)-(2,6-dimethoxyphenyl)methanamine
CID 114885870
(5-chloro-2-fluorophenyl)-(2,5-dichlorophenyl)methanamine
CID 43344675
(2-chloro-5-fluorophenyl)-(4-chlorophenyl)methanamine
CID 105394650
(2,5-difluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanamine
CID 106881519
2-(2-chlorophenyl)-1-(2,5-difluorophenyl)ethanamine
CID 43197901
(2-chloro-4-fluorophenyl)-(2,4,6-trifluorophenyl)methanamine
CID 43198689
(2-chloro-5-fluorophenyl)-(2,4-difluoro-5-methylphenyl)methanamine
CID 105397363
(2-chloro-5-fluorophenyl)-(2,4-difluorophenyl)methanamine
CID 105394907
(2-chloro-4-fluorophenyl)-(2-chlorophenyl)methanamine
CID 62945856
(2,6-dichlorophenyl)-(2,6-difluoro-3-methylphenyl)methanamine
CID 105027044

Frequently Asked Questions

What is the IUPAC name of (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine?
The IUPAC name of (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine (CID 43197833) is (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine.
What is the SMILES notation for (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine?
The canonical SMILES for (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine is NC(c1cc(F)ccc1F)c1c(Cl)cccc1Cl.
What is the InChIKey of (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine?
The InChIKey is LVUZNICCRPZGMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl2F2N/c14-9-2-1-3-10(15)12(9)13(18)8-6-7(16)4-5-11(8)17/h1-6,13H,18H2.
What are the key properties of (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine?
(2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine has a molecular weight of 288.12 g/mol, XLogP of 4.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dichlorophenyl)-(2,5-difluorophenyl)methanamine is sourced from PubChem (CID 43197833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).