(2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine

C13H12F2N2 — CID 106755257

IUPAC(2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine
SMILESCc1cc(C(N)c2cc(F)ccc2F)ccn1
InChIInChI=1S/C13H12F2N2/c1-8-6-9(4-5-17-8)13(16)11-7-10(14)2-3-12(11)15/h2-7,13H,16H2,1H3
InChIKeyANHNSXWXMIBELV-UHFFFAOYSA-N
MW234.25 g/mol
LogP2.72
Rot. Bonds2

About (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine

(2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine (PubChem CID 106755257) has the molecular formula C13H12F2N2 and a molecular weight of 234.25 g/mol. Its IUPAC name is (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine.

Molecular Properties

Compound Name(2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine
PubChem CID106755257
Molecular FormulaC13H12F2N2
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name(2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine
SMILESCc1cc(C(N)c2cc(F)ccc2F)ccn1
InChIInChI=1S/C13H12F2N2/c1-8-6-9(4-5-17-8)13(16)11-7-10(14)2-3-12(11)15/h2-7,13H,16H2,1H3
InChIKeyANHNSXWXMIBELV-UHFFFAOYSA-N
XLogP2.72
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-fluoro-2-methylphenyl)-N-methyl-1-(2-methyl-4-pyridinyl)methanamine
CID 106755234
(4-fluoro-2-methylphenyl)-(2-methyl-4-pyridinyl)methanol
CID 106756177
(2,5-difluorophenyl)-(1-methylimidazol-2-yl)methanamine
CID 63974752
(2-chloro-5-fluorophenyl)-(3-fluoro-4-methylphenyl)methanamine
CID 105394677
(2,5-difluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanamine
CID 106881519
(2,5-difluorophenyl)-(4-methylsulfonylphenyl)methanamine
CID 43197870
[(3,4-difluorophenyl)-(2-methyl-4-pyridinyl)methyl]hydrazine
CID 106756542
[3-(aminomethyl)phenyl]-(2,5-difluorophenyl)methanamine
CID 116936966
N-[(2,4-difluorophenyl)-(2-methyl-4-pyridinyl)methyl]propan-1-amine
CID 106755255
isoquinolin-4-yl-(2-methyl-4-pyridinyl)methanamine
CID 106755324
(3,4-difluorophenyl)-(2-fluoro-5-methylphenyl)methanamine
CID 62515674
(2,5-difluorophenyl)-(1,5-dimethylpyrazol-3-yl)methanamine
CID 114219213

Frequently Asked Questions

What is the IUPAC name of (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine?
The IUPAC name of (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine (CID 106755257) is (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine.
What is the SMILES notation for (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine?
The canonical SMILES for (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine is Cc1cc(C(N)c2cc(F)ccc2F)ccn1.
What is the InChIKey of (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine?
The InChIKey is ANHNSXWXMIBELV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F2N2/c1-8-6-9(4-5-17-8)13(16)11-7-10(14)2-3-12(11)15/h2-7,13H,16H2,1H3.
What are the key properties of (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine?
(2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine has a molecular weight of 234.25 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-difluorophenyl)-(2-methyl-4-pyridinyl)methanamine is sourced from PubChem (CID 106755257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).