2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine

C24H23F2N5 — CID 162026983

IUPAC2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine
SMILESCc1cccc(-c2[nH]c(CN(C)CCc3c(F)cccc3F)nc2-c2ccncc2)n1
InChIInChI=1S/C24H23F2N5/c1-16-5-3-8-21(28-16)24-23(17-9-12-27-13-10-17)29-22(30-24)15-31(2)14-11-18-19(25)6-4-7-20(18)26/h3-10,12-13H,11,14-15H2,1-2H3,(H,29,30)
InChIKeyYVMYLGHMUDVOAR-UHFFFAOYSA-N
MW419.48 g/mol
LogP4.79
Rot. Bonds7

About 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine

2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine (PubChem CID 162026983) has the molecular formula C24H23F2N5 and a molecular weight of 419.48 g/mol. Its IUPAC name is 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine.

Molecular Properties

Compound Name2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine
PubChem CID162026983
Molecular FormulaC24H23F2N5
Molecular Weight419.48 g/mol
Exact Mass419.19
IUPAC Name2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine
SMILESCc1cccc(-c2[nH]c(CN(C)CCc3c(F)cccc3F)nc2-c2ccncc2)n1
InChIInChI=1S/C24H23F2N5/c1-16-5-3-8-21(28-16)24-23(17-9-12-27-13-10-17)29-22(30-24)15-31(2)14-11-18-19(25)6-4-7-20(18)26/h3-10,12-13H,11,14-15H2,1-2H3,(H,29,30)
InChIKeyYVMYLGHMUDVOAR-UHFFFAOYSA-N
XLogP4.79
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.48
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]ethanamine
CID 162204745
N-methyl-1-(2-methylphenyl)-N-[[5-(6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-yl]methyl]methanamine
CID 159562702
N-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]methyl]-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
CID 67595540
1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine
CID 159784208
2-fluoro-5-[[5-(6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-yl]methyl]phenol
CID 59160535
6-[2-[(3-bromo-4-fluorophenyl)methyl]-5-(6-methyl-2-pyridinyl)-1H-imidazol-4-yl]quinoxaline
CID 44545647
6-[2-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-(6-methyl-2-pyridinyl)-1H-imidazol-4-yl]quinoxaline
CID 44545580
2-[4-(1,3-benzodioxol-5-yl)-2-[(3-fluorophenyl)methyl]-1H-imidazol-5-yl]-6-methylpyridine
CID 44546379
2-[4-(1,3-benzodioxol-5-yl)-2-butyl-1H-imidazol-5-yl]-6-methylpyridine
CID 142081726
2-(2-chloro-6-fluorophenyl)-N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]ethanamine;bis(2,2,2-trifluoroacetic acid)
CID 154885257
6-[2-[(3-fluoro-4-methoxyphenyl)methyl]-5-(6-methyl-2-pyridinyl)-1H-imidazol-4-yl]quinoline
CID 44545506
(1S,2R)-1-[methyl-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]amino]-2,3-dihydro-1H-inden-2-ol
CID 139569290

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine?
The IUPAC name of 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine (CID 162026983) is 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine.
What is the SMILES notation for 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine?
The canonical SMILES for 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine is Cc1cccc(-c2[nH]c(CN(C)CCc3c(F)cccc3F)nc2-c2ccncc2)n1.
What is the InChIKey of 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine?
The InChIKey is YVMYLGHMUDVOAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23F2N5/c1-16-5-3-8-21(28-16)24-23(17-9-12-27-13-10-17)29-22(30-24)15-31(2)14-11-18-19(25)6-4-7-20(18)26/h3-10,12-13H,11,14-15H2,1-2H3,(H,29,30).
What are the key properties of 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine?
2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine has a molecular weight of 419.48 g/mol, XLogP of 4.79, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-pyridin-4-yl-1H-imidazol-2-yl]methyl]ethanamine is sourced from PubChem (CID 162026983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).