N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide

C21H23N3O2 — CID 94092022

IUPACN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide
SMILESCc1cccn2c(NC(=O)CC[C@H]3CCCO3)c(-c3ccccc3)nc12
InChIInChI=1S/C21H23N3O2/c1-15-7-5-13-24-20(15)23-19(16-8-3-2-4-9-16)21(24)22-18(25)12-11-17-10-6-14-26-17/h2-5,7-9,13,17H,6,10-12,14H2,1H3,(H,22,25)/t17-/m1/s1
InChIKeyPGQBOMZPHBZCGS-QGZVFWFLSA-N
MW349.43 g/mol
LogP4.21
Rot. Bonds5

About N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide

N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide (PubChem CID 94092022) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide.

Molecular Properties

Compound NameN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide
PubChem CID94092022
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC NameN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide
SMILESCc1cccn2c(NC(=O)CC[C@H]3CCCO3)c(-c3ccccc3)nc12
InChIInChI=1S/C21H23N3O2/c1-15-7-5-13-24-20(15)23-19(16-8-3-2-4-9-16)21(24)22-18(25)12-11-17-10-6-14-26-17/h2-5,7-9,13,17H,6,10-12,14H2,1H3,(H,22,25)/t17-/m1/s1
InChIKeyPGQBOMZPHBZCGS-QGZVFWFLSA-N
XLogP4.21
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide?
The IUPAC name of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide (CID 94092022) is N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide.
What is the SMILES notation for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide?
The canonical SMILES for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide is Cc1cccn2c(NC(=O)CC[C@H]3CCCO3)c(-c3ccccc3)nc12.
What is the InChIKey of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide?
The InChIKey is PGQBOMZPHBZCGS-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-15-7-5-13-24-20(15)23-19(16-8-3-2-4-9-16)21(24)22-18(25)12-11-17-10-6-14-26-17/h2-5,7-9,13,17H,6,10-12,14H2,1H3,(H,22,25)/t17-/m1/s1.
What are the key properties of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide?
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide has a molecular weight of 349.43 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide is sourced from PubChem (CID 94092022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).