3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole

C17H14FN3 — CID 11780883

IUPAC3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
SMILESFc1ccc(-c2c(-c3cccnc3)nc3n2CCC3)cc1
InChIInChI=1S/C17H14FN3/c18-14-7-5-12(6-8-14)17-16(13-3-1-9-19-11-13)20-15-4-2-10-21(15)17/h1,3,5-9,11H,2,4,10H2
InChIKeyNGUFJMKCHCGHMC-UHFFFAOYSA-N
MW279.32 g/mol
LogP3.70
Rot. Bonds2

About 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole

3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole (PubChem CID 11780883) has the molecular formula C17H14FN3 and a molecular weight of 279.32 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole.

Molecular Properties

Compound Name3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
PubChem CID11780883
Molecular FormulaC17H14FN3
Molecular Weight279.32 g/mol
Exact Mass279.12
IUPAC Name3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
SMILESFc1ccc(-c2c(-c3cccnc3)nc3n2CCC3)cc1
InChIInChI=1S/C17H14FN3/c18-14-7-5-12(6-8-14)17-16(13-3-1-9-19-11-13)20-15-4-2-10-21(15)17/h1,3,5-9,11H,2,4,10H2
InChIKeyNGUFJMKCHCGHMC-UHFFFAOYSA-N
XLogP3.70
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.32
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The IUPAC name of 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole (CID 11780883) is 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole.
What is the SMILES notation for 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The canonical SMILES for 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole is Fc1ccc(-c2c(-c3cccnc3)nc3n2CCC3)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
The InChIKey is NGUFJMKCHCGHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3/c18-14-7-5-12(6-8-14)17-16(13-3-1-9-19-11-13)20-15-4-2-10-21(15)17/h1,3,5-9,11H,2,4,10H2.
What are the key properties of 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole?
3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole has a molecular weight of 279.32 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole is sourced from PubChem (CID 11780883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).