3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline

C15H11FN4 — CID 176667061

IUPAC3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline
SMILESFc1cccc2cc(C3=NCNn4cccc43)cnc12
InChIInChI=1S/C15H11FN4/c16-12-4-1-3-10-7-11(8-17-14(10)12)15-13-5-2-6-20(13)19-9-18-15/h1-8,19H,9H2
InChIKeyGYOJTSHAWLRQQO-UHFFFAOYSA-N
MW266.28 g/mol
LogP2.53
Rot. Bonds1

About 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline

3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline (PubChem CID 176667061) has the molecular formula C15H11FN4 and a molecular weight of 266.28 g/mol. Its IUPAC name is 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline.

Molecular Properties

Compound Name3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline
PubChem CID176667061
Molecular FormulaC15H11FN4
Molecular Weight266.28 g/mol
Exact Mass266.10
IUPAC Name3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline
SMILESFc1cccc2cc(C3=NCNn4cccc43)cnc12
InChIInChI=1S/C15H11FN4/c16-12-4-1-3-10-7-11(8-17-14(10)12)15-13-5-2-6-20(13)19-9-18-15/h1-8,19H,9H2
InChIKeyGYOJTSHAWLRQQO-UHFFFAOYSA-N
XLogP2.53
TPSA42.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-fluoro-5-(8-fluoroquinolin-3-yl)-2,2-dimethyl-3H-1,4-benzoxazepine
CID 67114177
4-(8-fluoroquinolin-3-yl)-2,2-dimethyl-1,3-benzothiazine
CID 165392471
8-fluoroquinoline-3-carboxylic acid;hydrate
CID 90668422
3-(3,3-dimethyl-6-pyridin-2-yl-4H-pyrrolo[1,2-a]pyrazin-1-yl)-8-fluoroquinoline
CID 156881432
4-(8-fluoroquinolin-3-yl)-1,2,2-trimethylquinazoline
CID 167451965
1-(8-fluoroquinolin-3-yl)ethanone
CID 75355413
(3S)-1-[3-(8-fluoroquinolin-3-yl)phenyl]-2-oxopyrrolidine-3-carboxylic acid
CID 170297085
(8-fluoroquinolin-3-yl)boronic acid
CID 67114195
N-[1-[5-(8-fluoroquinolin-3-yl)-1,2,4-oxadiazol-3-yl]cyclopentyl]benzamide
CID 139009744
(3S,4S)-5-bromo-1-(8-fluoroquinolin-3-yl)-3,4,6-trimethyl-3,4-dihydroisoquinoline
CID 171488615
(4S)-4-benzyl-2-(8-fluoroquinolin-3-yl)-4,6,6-trimethyl-5H-1,3-oxazine
CID 146460646
7,8-dichloro-4-(8-fluoroquinolin-3-yl)-2,2-dimethyl-1,3-benzothiazine
CID 165392469

Frequently Asked Questions

What is the IUPAC name of 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline?
The IUPAC name of 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline (CID 176667061) is 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline.
What is the SMILES notation for 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline?
The canonical SMILES for 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline is Fc1cccc2cc(C3=NCNn4cccc43)cnc12.
What is the InChIKey of 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline?
The InChIKey is GYOJTSHAWLRQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4/c16-12-4-1-3-10-7-11(8-17-14(10)12)15-13-5-2-6-20(13)19-9-18-15/h1-8,19H,9H2.
What are the key properties of 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline?
3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline has a molecular weight of 266.28 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2-dihydropyrrolo[2,1-f][1,2,4]triazin-4-yl)-8-fluoroquinoline is sourced from PubChem (CID 176667061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).