3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine

C22H22N4 — CID 39130256

IUPAC3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine
SMILESCN(Cc1ccccc1)Cc1c(-c2ccccc2)nc2ccc(N)cn12
InChIInChI=1S/C22H22N4/c1-25(14-17-8-4-2-5-9-17)16-20-22(18-10-6-3-7-11-18)24-21-13-12-19(23)15-26(20)21/h2-13,15H,14,16,23H2,1H3
InChIKeySQFMOAQGVWREBN-UHFFFAOYSA-N
MW342.45 g/mol
LogP4.22
Rot. Bonds5

About 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine

3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine (PubChem CID 39130256) has the molecular formula C22H22N4 and a molecular weight of 342.45 g/mol. Its IUPAC name is 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine
PubChem CID39130256
Molecular FormulaC22H22N4
Molecular Weight342.45 g/mol
Exact Mass342.18
IUPAC Name3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine
SMILESCN(Cc1ccccc1)Cc1c(-c2ccccc2)nc2ccc(N)cn12
InChIInChI=1S/C22H22N4/c1-25(14-17-8-4-2-5-9-17)16-20-22(18-10-6-3-7-11-18)24-21-13-12-19(23)15-26(20)21/h2-13,15H,14,16,23H2,1H3
InChIKeySQFMOAQGVWREBN-UHFFFAOYSA-N
XLogP4.22
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.45
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine (CID 39130256) is 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine is CN(Cc1ccccc1)Cc1c(-c2ccccc2)nc2ccc(N)cn12.
What is the InChIKey of 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine?
The InChIKey is SQFMOAQGVWREBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4/c1-25(14-17-8-4-2-5-9-17)16-20-22(18-10-6-3-7-11-18)24-21-13-12-19(23)15-26(20)21/h2-13,15H,14,16,23H2,1H3.
What are the key properties of 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine?
3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine has a molecular weight of 342.45 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 39130256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).