8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine

C13H16FN3 — CID 115039507

IUPAC8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine
SMILESCc1c(CC2CCCN2)nc2c(F)cccn12
InChIInChI=1S/C13H16FN3/c1-9-12(8-10-4-2-6-15-10)16-13-11(14)5-3-7-17(9)13/h3,5,7,10,15H,2,4,6,8H2,1H3
InChIKeyDKASRSHQZLGATD-UHFFFAOYSA-N
MW233.29 g/mol
LogP2.08
Rot. Bonds2

About 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine

8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine (PubChem CID 115039507) has the molecular formula C13H16FN3 and a molecular weight of 233.29 g/mol. Its IUPAC name is 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine
PubChem CID115039507
Molecular FormulaC13H16FN3
Molecular Weight233.29 g/mol
Exact Mass233.13
IUPAC Name8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine
SMILESCc1c(CC2CCCN2)nc2c(F)cccn12
InChIInChI=1S/C13H16FN3/c1-9-12(8-10-4-2-6-15-10)16-13-11(14)5-3-7-17(9)13/h3,5,7,10,15H,2,4,6,8H2,1H3
InChIKeyDKASRSHQZLGATD-UHFFFAOYSA-N
XLogP2.08
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,6,7,8-tetramethyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyridine
CID 58477959
2-cyclopropyl-8-fluoro-3-methylimidazo[1,2-a]pyridine
CID 89404565
9-fluoro-2-pyrrolidin-2-ylpyrido[1,2-a]pyrimidin-4-one
CID 115039373
2-[(2-fluoro-6-methylsulfanylphenyl)methyl]pyrrolidine
CID 117324200
2-[(2-chloro-3-fluorophenyl)methyl]pyrrolidine
CID 112654463
2-fluoro-N,N-dimethyl-6-(pyrrolidin-2-ylmethyl)aniline
CID 117118269
7-fluoro-1,2-dimethyl-3-(piperidin-2-ylmethyl)indole
CID 84638279
1-bromo-8-chloro-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine
CID 117254720
4-(2-fluorophenyl)-5-methyl-2-(pyrrolidin-2-ylmethyl)-1H-imidazole
CID 112679327
1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol
CID 117254727
(2S)-2-[(3-fluoro-4-methylphenyl)methyl]pyrrolidine
CID 58580794
7-fluoro-3-(piperidin-2-ylmethyl)-2H-indazole
CID 84696786

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine (CID 115039507) is 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine is Cc1c(CC2CCCN2)nc2c(F)cccn12.
What is the InChIKey of 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is DKASRSHQZLGATD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3/c1-9-12(8-10-4-2-6-15-10)16-13-11(14)5-3-7-17(9)13/h3,5,7,10,15H,2,4,6,8H2,1H3.
What are the key properties of 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine?
8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 233.29 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-3-methyl-2-(pyrrolidin-2-ylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 115039507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).