6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine

C18H18FN3 — CID 171799333

IUPAC6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine
SMILESCc1cnc2ccc(N3CCCC3c3ccc(F)cc3)cn12
InChIInChI=1S/C18H18FN3/c1-13-11-20-18-9-8-16(12-22(13)18)21-10-2-3-17(21)14-4-6-15(19)7-5-14/h4-9,11-12,17H,2-3,10H2,1H3
InChIKeyHHPIMWHETFOZPW-UHFFFAOYSA-N
MW295.36 g/mol
LogP4.12
Rot. Bonds2

About 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine

6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine (PubChem CID 171799333) has the molecular formula C18H18FN3 and a molecular weight of 295.36 g/mol. Its IUPAC name is 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine
PubChem CID171799333
Molecular FormulaC18H18FN3
Molecular Weight295.36 g/mol
Exact Mass295.15
IUPAC Name6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine
SMILESCc1cnc2ccc(N3CCCC3c3ccc(F)cc3)cn12
InChIInChI=1S/C18H18FN3/c1-13-11-20-18-9-8-16(12-22(13)18)21-10-2-3-17(21)14-4-6-15(19)7-5-14/h4-9,11-12,17H,2-3,10H2,1H3
InChIKeyHHPIMWHETFOZPW-UHFFFAOYSA-N
XLogP4.12
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine?
The IUPAC name of 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine (CID 171799333) is 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine is Cc1cnc2ccc(N3CCCC3c3ccc(F)cc3)cn12.
What is the InChIKey of 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine?
The InChIKey is HHPIMWHETFOZPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3/c1-13-11-20-18-9-8-16(12-22(13)18)21-10-2-3-17(21)14-4-6-15(19)7-5-14/h4-9,11-12,17H,2-3,10H2,1H3.
What are the key properties of 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine?
6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine has a molecular weight of 295.36 g/mol, XLogP of 4.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 171799333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).