7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline

C20H16FN7 — CID 141370356

IUPAC7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline
SMILESCC(c1cc2cc(-c3cnn(C)c3)cnc2cc1F)n1cnc2nccnc21
InChIInChI=1S/C20H16FN7/c1-12(28-11-25-19-20(28)23-4-3-22-19)16-6-13-5-14(15-9-26-27(2)10-15)8-24-18(13)7-17(16)21/h3-12H,1-2H3
InChIKeyMDODAZMHXCTJQN-UHFFFAOYSA-N
MW373.40 g/mol
LogP3.52
Rot. Bonds3

About 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline

7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline (PubChem CID 141370356) has the molecular formula C20H16FN7 and a molecular weight of 373.40 g/mol. Its IUPAC name is 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline.

Molecular Properties

Compound Name7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline
PubChem CID141370356
Molecular FormulaC20H16FN7
Molecular Weight373.40 g/mol
Exact Mass373.15
IUPAC Name7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline
SMILESCC(c1cc2cc(-c3cnn(C)c3)cnc2cc1F)n1cnc2nccnc21
InChIInChI=1S/C20H16FN7/c1-12(28-11-25-19-20(28)23-4-3-22-19)16-6-13-5-14(15-9-26-27(2)10-15)8-24-18(13)7-17(16)21/h3-12H,1-2H3
InChIKeyMDODAZMHXCTJQN-UHFFFAOYSA-N
XLogP3.52
TPSA74.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.40
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline with MolForge

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Related Compounds

7-fluoro-6-[1-[5-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyrazin-3-yl]ethyl]quinoline
CID 141370339
7-fluoro-3-(1-methylpyrazol-4-yl)-6-[1-[6-(1-methylpyrazol-4-yl)-2H-triazolo[4,5-b]pyrazin-5-yl]ethyl]quinoline
CID 141456392
7-fluoro-6-[1-[5-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyrazin-3-yl]propyl]quinoline
CID 155549474
7-fluoro-3-(1-methylpyrazol-4-yl)-6-[1-[6-(4-methylsulfanylphenyl)-2H-triazolo[4,5-b]pyrazin-5-yl]ethyl]quinoline
CID 141456409
3-[(1S)-1-[7-fluoro-3-(1-methylpyrazol-4-yl)quinolin-6-yl]ethyl]-N-[(2-methoxy-3-pyridinyl)methyl]-2-methylimidazo[4,5-b]pyrazin-5-amine
CID 162691313
5,7-difluoro-6-[1-[5-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyrazin-3-yl]ethyl]quinoline
CID 141370291
4-[3-[1-(7-fluoroquinolin-6-yl)ethyl]imidazo[4,5-b]pyrazin-5-yl]aniline
CID 141370388
7-fluoro-6-[1-(6-isoquinolin-4-yl-2H-triazolo[4,5-b]pyrazin-5-yl)ethyl]-3-(1-methylpyrazol-4-yl)quinoline
CID 141456395
7-fluoro-6-[1-[5-(4-methylthiophen-2-yl)imidazo[4,5-b]pyrazin-3-yl]ethyl]quinoline
CID 175322316
2-[2-[7-fluoro-3-(1-methylpyrazol-4-yl)quinolin-6-yl]ethanimidoyl]-6-methylpyridazin-3-imine
CID 70665637
2-[1-[5,7-difluoro-3-(1-methylpyrazol-4-yl)quinolin-6-yl]ethyl]isoindole-1,3-dione
CID 141370379
N-[1-[3-(1-methylpyrazol-4-yl)quinolin-6-yl]ethylidene]hydroxylamine
CID 141370272

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline?
The IUPAC name of 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline (CID 141370356) is 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline.
What is the SMILES notation for 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline?
The canonical SMILES for 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline is CC(c1cc2cc(-c3cnn(C)c3)cnc2cc1F)n1cnc2nccnc21.
What is the InChIKey of 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline?
The InChIKey is MDODAZMHXCTJQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN7/c1-12(28-11-25-19-20(28)23-4-3-22-19)16-6-13-5-14(15-9-26-27(2)10-15)8-24-18(13)7-17(16)21/h3-12H,1-2H3.
What are the key properties of 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline?
7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline has a molecular weight of 373.40 g/mol, XLogP of 3.52, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-6-(1-imidazo[4,5-b]pyrazin-3-ylethyl)-3-(1-methylpyrazol-4-yl)quinoline is sourced from PubChem (CID 141370356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).