(2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine

C15H15F2N — CID 79522334

IUPAC(2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine
SMILESCc1cc(C)cc(C(N)c2c(F)cccc2F)c1
InChIInChI=1S/C15H15F2N/c1-9-6-10(2)8-11(7-9)15(18)14-12(16)4-3-5-13(14)17/h3-8,15H,18H2,1-2H3
InChIKeyPCSMRSFIOGGARN-UHFFFAOYSA-N
MW247.29 g/mol
LogP3.63
Rot. Bonds2

About (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine

(2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine (PubChem CID 79522334) has the molecular formula C15H15F2N and a molecular weight of 247.29 g/mol. Its IUPAC name is (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine.

Molecular Properties

Compound Name(2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine
PubChem CID79522334
Molecular FormulaC15H15F2N
Molecular Weight247.29 g/mol
Exact Mass247.12
IUPAC Name(2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine
SMILESCc1cc(C)cc(C(N)c2c(F)cccc2F)c1
InChIInChI=1S/C15H15F2N/c1-9-6-10(2)8-11(7-9)15(18)14-12(16)4-3-5-13(14)17/h3-8,15H,18H2,1-2H3
InChIKeyPCSMRSFIOGGARN-UHFFFAOYSA-N
XLogP3.63
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3,5-dimethylphenyl)-(2,3,4,5,6-pentafluorophenyl)methanamine
CID 115796552
bis(3,5-dimethylphenyl)methanamine
CID 115796405
(3-bromo-5-methylphenyl)-(2,4,6-trifluorophenyl)methanamine
CID 104851108
N-[(2,6-difluorophenyl)-(3,5-dimethylphenyl)methyl]ethanamine
CID 79522408
(2,4-difluorophenyl)-(3,5-dimethylphenyl)methanamine
CID 43197780
(2,6-difluorophenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 115859741
(4-chloro-2-fluorophenyl)-(3,5-dimethylphenyl)methanamine
CID 63081418
(2-bromo-6-fluorophenyl)-(3,5-difluorophenyl)methanamine
CID 114886872
(2,3-difluoro-4-methylphenyl)-(3,5-dimethylphenyl)methanamine
CID 107515958
(3-chloro-4-methoxyphenyl)-(2,6-difluorophenyl)methanamine
CID 43130972
(2,6-difluorophenyl)-(2,3-dihydro-1H-inden-5-yl)methanamine
CID 43115569
(3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine
CID 79704327

Frequently Asked Questions

What is the IUPAC name of (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine?
The IUPAC name of (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine (CID 79522334) is (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine.
What is the SMILES notation for (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine?
The canonical SMILES for (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine is Cc1cc(C)cc(C(N)c2c(F)cccc2F)c1.
What is the InChIKey of (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine?
The InChIKey is PCSMRSFIOGGARN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N/c1-9-6-10(2)8-11(7-9)15(18)14-12(16)4-3-5-13(14)17/h3-8,15H,18H2,1-2H3.
What are the key properties of (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine?
(2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine has a molecular weight of 247.29 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-difluorophenyl)-(3,5-dimethylphenyl)methanamine is sourced from PubChem (CID 79522334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).