5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole

C19H15FN4 — CID 121350298

IUPAC5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole
SMILESFc1cccc(-c2nc3n(c2-c2ccc4[nH]ncc4c2)CCC3)c1
InChIInChI=1S/C19H15FN4/c20-15-4-1-3-12(10-15)18-19(24-8-2-5-17(24)22-18)13-6-7-16-14(9-13)11-21-23-16/h1,3-4,6-7,9-11H,2,5,8H2,(H,21,23)
InChIKeyQQWVRDRAMFDOIW-UHFFFAOYSA-N
MW318.36 g/mol
LogP4.18
Rot. Bonds2

About 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole

5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole (PubChem CID 121350298) has the molecular formula C19H15FN4 and a molecular weight of 318.36 g/mol. Its IUPAC name is 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole.

Molecular Properties

Compound Name5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole
PubChem CID121350298
Molecular FormulaC19H15FN4
Molecular Weight318.36 g/mol
Exact Mass318.13
IUPAC Name5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole
SMILESFc1cccc(-c2nc3n(c2-c2ccc4[nH]ncc4c2)CCC3)c1
InChIInChI=1S/C19H15FN4/c20-15-4-1-3-12(10-15)18-19(24-8-2-5-17(24)22-18)13-6-7-16-14(9-13)11-21-23-16/h1,3-4,6-7,9-11H,2,5,8H2,(H,21,23)
InChIKeyQQWVRDRAMFDOIW-UHFFFAOYSA-N
XLogP4.18
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.36
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[2-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole
CID 121358918
6-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1,3-benzothiazole;6-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole;6-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]quinoxaline
CID 121350147
5-[2-(4-fluoro-2,3-dimethylphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole;molecular hydrogen
CID 145086204
6-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1,3-benzothiazole
CID 121350148
3-(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)-2-(1H-indazol-5-yl)quinoline
CID 150226086
2,3-bis(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 102200708
6-[2-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]quinoxaline
CID 121358921
3-(7-fluoro-3,4-dihydro-2H-quinolin-1-yl)-2-(1H-indazol-5-yl)quinoxaline-6-carboxylic acid
CID 70645781
6-[2-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1,3-benzothiazole
CID 121358920
6-[2-(2,3,5-trifluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]quinoline
CID 121349974
6-[2-(4-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3-methylimidazo[1,2-a]pyridine
CID 145148982
6-[2-(4-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine
CID 121350007

Frequently Asked Questions

What is the IUPAC name of 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole?
The IUPAC name of 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole (CID 121350298) is 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole.
What is the SMILES notation for 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole?
The canonical SMILES for 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole is Fc1cccc(-c2nc3n(c2-c2ccc4[nH]ncc4c2)CCC3)c1.
What is the InChIKey of 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole?
The InChIKey is QQWVRDRAMFDOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4/c20-15-4-1-3-12(10-15)18-19(24-8-2-5-17(24)22-18)13-6-7-16-14(9-13)11-21-23-16/h1,3-4,6-7,9-11H,2,5,8H2,(H,21,23).
What are the key properties of 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole?
5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole has a molecular weight of 318.36 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-1H-indazole is sourced from PubChem (CID 121350298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).