4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide

C20H21N3O2 — CID 136567995

IUPAC4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide
SMILESCc1nc2ccccn2c1CNC(=O)C1(C)CCOc2ccccc21
InChIInChI=1S/C20H21N3O2/c1-14-16(23-11-6-5-9-18(23)22-14)13-21-19(24)20(2)10-12-25-17-8-4-3-7-15(17)20/h3-9,11H,10,12-13H2,1-2H3,(H,21,24)
InChIKeyAWAUKAUYPUFGFS-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.00
Rot. Bonds3

About 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide

4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide (PubChem CID 136567995) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide
PubChem CID136567995
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide
SMILESCc1nc2ccccn2c1CNC(=O)C1(C)CCOc2ccccc21
InChIInChI=1S/C20H21N3O2/c1-14-16(23-11-6-5-9-18(23)22-14)13-21-19(24)20(2)10-12-25-17-8-4-3-7-15(17)20/h3-9,11H,10,12-13H2,1-2H3,(H,21,24)
InChIKeyAWAUKAUYPUFGFS-UHFFFAOYSA-N
XLogP3.00
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide?
The IUPAC name of 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide (CID 136567995) is 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide.
What is the SMILES notation for 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide?
The canonical SMILES for 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide is Cc1nc2ccccn2c1CNC(=O)C1(C)CCOc2ccccc21.
What is the InChIKey of 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide?
The InChIKey is AWAUKAUYPUFGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-14-16(23-11-6-5-9-18(23)22-14)13-21-19(24)20(2)10-12-25-17-8-4-3-7-15(17)20/h3-9,11H,10,12-13H2,1-2H3,(H,21,24).
What are the key properties of 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide?
4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,3-dihydrochromene-4-carboxamide is sourced from PubChem (CID 136567995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).