(3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine

C14H12ClF2N — CID 64712292

IUPAC(3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine
SMILESCc1ccc(F)cc1C(N)c1cccc(Cl)c1F
InChIInChI=1S/C14H12ClF2N/c1-8-5-6-9(16)7-11(8)14(18)10-3-2-4-12(15)13(10)17/h2-7,14H,18H2,1H3
InChIKeyVYAPVMJXVJWWNM-UHFFFAOYSA-N
MW267.71 g/mol
LogP3.97
Rot. Bonds2

About (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine

(3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine (PubChem CID 64712292) has the molecular formula C14H12ClF2N and a molecular weight of 267.71 g/mol. Its IUPAC name is (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine.

Molecular Properties

Compound Name(3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine
PubChem CID64712292
Molecular FormulaC14H12ClF2N
Molecular Weight267.71 g/mol
Exact Mass267.06
IUPAC Name(3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine
SMILESCc1ccc(F)cc1C(N)c1cccc(Cl)c1F
InChIInChI=1S/C14H12ClF2N/c1-8-5-6-9(16)7-11(8)14(18)10-3-2-4-12(15)13(10)17/h2-7,14H,18H2,1H3
InChIKeyVYAPVMJXVJWWNM-UHFFFAOYSA-N
XLogP3.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.71
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-chlorophenyl)-(5-fluoro-2-methylphenyl)methanamine
CID 62387434
(3-chloro-2-fluorophenyl)-(2,3-difluoro-4-methylphenyl)methanamine
CID 107513399
(3-chloro-2-fluorophenyl)-(2,3-dimethylphenyl)methanamine
CID 64713808
(5-fluoro-2-methylphenyl)-(2-methylsulfanylphenyl)methanamine
CID 115852060
N-[(3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methyl]propan-1-amine
CID 64715289
(3-chloro-2-fluorophenyl)-(2-fluoro-3-methoxyphenyl)methanamine
CID 82808026
(5-chloro-2-methylphenyl)-(2-fluoro-3-methoxyphenyl)methanamine
CID 105024991
(2,5-dimethylphenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 81478085
[(2,3-dichlorophenyl)-(5-fluoro-2-methylphenyl)methyl]hydrazine
CID 105211607
(2-tert-butylphenyl)-(5-fluoro-2-methylphenyl)methanamine
CID 115852087
(2,3-difluorophenyl)-(2,5-dimethylphenyl)methanamine
CID 55101767
(2-chloro-4-fluorophenyl)-(2-chlorophenyl)methanamine
CID 62945856

Frequently Asked Questions

What is the IUPAC name of (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine?
The IUPAC name of (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine (CID 64712292) is (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine.
What is the SMILES notation for (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine?
The canonical SMILES for (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine is Cc1ccc(F)cc1C(N)c1cccc(Cl)c1F.
What is the InChIKey of (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine?
The InChIKey is VYAPVMJXVJWWNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClF2N/c1-8-5-6-9(16)7-11(8)14(18)10-3-2-4-12(15)13(10)17/h2-7,14H,18H2,1H3.
What are the key properties of (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine?
(3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine has a molecular weight of 267.71 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-fluorophenyl)-(5-fluoro-2-methylphenyl)methanamine is sourced from PubChem (CID 64712292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).