5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine

C16H16FN3 — CID 172802521

IUPAC5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine
SMILESCc1cc(CN2C=CNC2)cnc1-c1cccc(F)c1
InChIInChI=1S/C16H16FN3/c1-12-7-13(10-20-6-5-18-11-20)9-19-16(12)14-3-2-4-15(17)8-14/h2-9,18H,10-11H2,1H3
InChIKeyRBEWHXSVLJUYFE-UHFFFAOYSA-N
MW269.32 g/mol
LogP3.03
Rot. Bonds3

About 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine

5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine (PubChem CID 172802521) has the molecular formula C16H16FN3 and a molecular weight of 269.32 g/mol. Its IUPAC name is 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine.

Molecular Properties

Compound Name5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine
PubChem CID172802521
Molecular FormulaC16H16FN3
Molecular Weight269.32 g/mol
Exact Mass269.13
IUPAC Name5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine
SMILESCc1cc(CN2C=CNC2)cnc1-c1cccc(F)c1
InChIInChI=1S/C16H16FN3/c1-12-7-13(10-20-6-5-18-11-20)9-19-16(12)14-3-2-4-15(17)8-14/h2-9,18H,10-11H2,1H3
InChIKeyRBEWHXSVLJUYFE-UHFFFAOYSA-N
XLogP3.03
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1,2-dihydroimidazol-3-ylmethyl)-2-(4-fluoro-3-methylphenyl)pyridine
CID 172708874
3-[(4-fluorophenyl)methyl]-1,2-dihydroimidazole
CID 175147591
6-(3,4-difluorophenyl)-2-(1,2-dihydroimidazol-3-ylmethyl)-3-methylpyridine
CID 172797816
5-fluoro-3-methyl-2-phenylpyridine
CID 46314858
3-fluoro-2-(4-fluoro-3-methylphenyl)-5-(pyrazol-1-ylmethyl)pyridine
CID 175294448
7-(3-fluorophenyl)-N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-5H-pyrido[3,4-c]azepin-1-amine
CID 123301580
3-fluoro-2-(3-fluorophenyl)-6-methylpyridine
CID 46312581
[3-(5-amino-3-methyl-2-pyridinyl)phenyl]methanol
CID 110282145
3-(5-ethyl-3-methyl-2-pyridinyl)benzamide
CID 143772061
2-[5-chloro-6-(3-fluorophenyl)-3-pyridinyl]acetic acid
CID 131869835
5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine
CID 140847511
2-chloro-5-(3-fluorophenyl)-3-methylpyridine
CID 46312013

Frequently Asked Questions

What is the IUPAC name of 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine?
The IUPAC name of 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine (CID 172802521) is 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine.
What is the SMILES notation for 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine?
The canonical SMILES for 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine is Cc1cc(CN2C=CNC2)cnc1-c1cccc(F)c1.
What is the InChIKey of 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine?
The InChIKey is RBEWHXSVLJUYFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3/c1-12-7-13(10-20-6-5-18-11-20)9-19-16(12)14-3-2-4-15(17)8-14/h2-9,18H,10-11H2,1H3.
What are the key properties of 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine?
5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine has a molecular weight of 269.32 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,2-dihydroimidazol-3-ylmethyl)-2-(3-fluorophenyl)-3-methylpyridine is sourced from PubChem (CID 172802521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).