6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline

C20H17N3 — CID 39319431

IUPAC6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline
SMILESCc1ccc2nc(/C=C/c3nc(C)n4ccccc34)ccc2c1
InChIInChI=1S/C20H17N3/c1-14-6-10-18-16(13-14)7-8-17(22-18)9-11-19-20-5-3-4-12-23(20)15(2)21-19/h3-13H,1-2H3/b11-9+
InChIKeyVLFMJZINSCREJE-PKNBQFBNSA-N
MW299.38 g/mol
LogP4.67
Rot. Bonds2

About 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline

6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline (PubChem CID 39319431) has the molecular formula C20H17N3 and a molecular weight of 299.38 g/mol. Its IUPAC name is 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline.

Molecular Properties

Compound Name6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline
PubChem CID39319431
Molecular FormulaC20H17N3
Molecular Weight299.38 g/mol
Exact Mass299.14
IUPAC Name6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline
SMILESCc1ccc2nc(/C=C/c3nc(C)n4ccccc34)ccc2c1
InChIInChI=1S/C20H17N3/c1-14-6-10-18-16(13-14)7-8-17(22-18)9-11-19-20-5-3-4-12-23(20)15(2)21-19/h3-13H,1-2H3/b11-9+
InChIKeyVLFMJZINSCREJE-PKNBQFBNSA-N
XLogP4.67
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline?
The IUPAC name of 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline (CID 39319431) is 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline.
What is the SMILES notation for 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline?
The canonical SMILES for 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline is Cc1ccc2nc(/C=C/c3nc(C)n4ccccc34)ccc2c1.
What is the InChIKey of 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline?
The InChIKey is VLFMJZINSCREJE-PKNBQFBNSA-N. The full InChI is InChI=1S/C20H17N3/c1-14-6-10-18-16(13-14)7-8-17(22-18)9-11-19-20-5-3-4-12-23(20)15(2)21-19/h3-13H,1-2H3/b11-9+.
What are the key properties of 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline?
6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline has a molecular weight of 299.38 g/mol, XLogP of 4.67, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[(E)-2-(3-methylimidazo[1,5-a]pyridin-1-yl)ethenyl]quinoline is sourced from PubChem (CID 39319431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).