5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine

C15H16F2N2 — CID 134417202

IUPAC5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine
SMILESCc1cc(-c2ccc(F)c(C)c2F)cnc1N(C)C
InChIInChI=1S/C15H16F2N2/c1-9-7-11(8-18-15(9)19(3)4)12-5-6-13(16)10(2)14(12)17/h5-8H,1-4H3
InChIKeyHAKSFSBRRDKPAF-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.71
Rot. Bonds2

About 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine

5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine (PubChem CID 134417202) has the molecular formula C15H16F2N2 and a molecular weight of 262.30 g/mol. Its IUPAC name is 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine.

Molecular Properties

Compound Name5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine
PubChem CID134417202
Molecular FormulaC15H16F2N2
Molecular Weight262.30 g/mol
Exact Mass262.13
IUPAC Name5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine
SMILESCc1cc(-c2ccc(F)c(C)c2F)cnc1N(C)C
InChIInChI=1S/C15H16F2N2/c1-9-7-11(8-18-15(9)19(3)4)12-5-6-13(16)10(2)14(12)17/h5-8H,1-4H3
InChIKeyHAKSFSBRRDKPAF-UHFFFAOYSA-N
XLogP3.71
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine?
The IUPAC name of 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine (CID 134417202) is 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine.
What is the SMILES notation for 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine?
The canonical SMILES for 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine is Cc1cc(-c2ccc(F)c(C)c2F)cnc1N(C)C.
What is the InChIKey of 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine?
The InChIKey is HAKSFSBRRDKPAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2/c1-9-7-11(8-18-15(9)19(3)4)12-5-6-13(16)10(2)14(12)17/h5-8H,1-4H3.
What are the key properties of 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine?
5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine has a molecular weight of 262.30 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-difluoro-3-methylphenyl)-N,N,3-trimethylpyridin-2-amine is sourced from PubChem (CID 134417202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).