7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one

C21H20FN5O — CID 168756185

IUPAC7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one
SMILESCc1cn2cc(-c3ccc4c(=O)n(N5CCCCC5)cnc4c3)cc(F)c2n1
InChIInChI=1S/C21H20FN5O/c1-14-11-25-12-16(9-18(22)20(25)24-14)15-5-6-17-19(10-15)23-13-27(21(17)28)26-7-3-2-4-8-26/h5-6,9-13H,2-4,7-8H2,1H3
InChIKeyJMXAZZFRLOEZNP-UHFFFAOYSA-N
MW377.42 g/mol
LogP3.28
Rot. Bonds2

About 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one

7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one (PubChem CID 168756185) has the molecular formula C21H20FN5O and a molecular weight of 377.42 g/mol. Its IUPAC name is 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one.

Molecular Properties

Compound Name7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one
PubChem CID168756185
Molecular FormulaC21H20FN5O
Molecular Weight377.42 g/mol
Exact Mass377.17
IUPAC Name7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one
SMILESCc1cn2cc(-c3ccc4c(=O)n(N5CCCCC5)cnc4c3)cc(F)c2n1
InChIInChI=1S/C21H20FN5O/c1-14-11-25-12-16(9-18(22)20(25)24-14)15-5-6-17-19(10-15)23-13-27(21(17)28)26-7-3-2-4-8-26/h5-6,9-13H,2-4,7-8H2,1H3
InChIKeyJMXAZZFRLOEZNP-UHFFFAOYSA-N
XLogP3.28
TPSA55.43 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one?
The IUPAC name of 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one (CID 168756185) is 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one.
What is the SMILES notation for 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one?
The canonical SMILES for 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one is Cc1cn2cc(-c3ccc4c(=O)n(N5CCCCC5)cnc4c3)cc(F)c2n1.
What is the InChIKey of 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one?
The InChIKey is JMXAZZFRLOEZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN5O/c1-14-11-25-12-16(9-18(22)20(25)24-14)15-5-6-17-19(10-15)23-13-27(21(17)28)26-7-3-2-4-8-26/h5-6,9-13H,2-4,7-8H2,1H3.
What are the key properties of 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one?
7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one has a molecular weight of 377.42 g/mol, XLogP of 3.28, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-1-ylquinazolin-4-one is sourced from PubChem (CID 168756185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).