N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C18H22N4O4 — CID 147775711

IUPACN-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCOc1cccn2c(C(=O)NC3(C#N)COC(C)(C)OC3)c(C)nc12
InChIInChI=1S/C18H22N4O4/c1-5-24-13-7-6-8-22-14(12(2)20-15(13)22)16(23)21-18(9-19)10-25-17(3,4)26-11-18/h6-8H,5,10-11H2,1-4H3,(H,21,23)
InChIKeyHGUJUKOXYQUUIG-UHFFFAOYSA-N
MW358.40 g/mol
LogP1.82
Rot. Bonds4

About N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide

N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 147775711) has the molecular formula C18H22N4O4 and a molecular weight of 358.40 g/mol. Its IUPAC name is N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID147775711
Molecular FormulaC18H22N4O4
Molecular Weight358.40 g/mol
Exact Mass358.16
IUPAC NameN-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCOc1cccn2c(C(=O)NC3(C#N)COC(C)(C)OC3)c(C)nc12
InChIInChI=1S/C18H22N4O4/c1-5-24-13-7-6-8-22-14(12(2)20-15(13)22)16(23)21-18(9-19)10-25-17(3,4)26-11-18/h6-8H,5,10-11H2,1-4H3,(H,21,23)
InChIKeyHGUJUKOXYQUUIG-UHFFFAOYSA-N
XLogP1.82
TPSA97.88 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

8-ethoxy-2-methyl-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 110659989
2-[2,2-dimethyl-5-(1-methyltetrazol-5-yl)-1,3-dioxan-5-yl]-1-(8-ethoxy-2-methylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 159621831
N-(2,2-dimethyl-5-phenyl-1,3-dioxan-5-yl)-8-[(2-fluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90091097
N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90192608
8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 110659980
8-ethoxy-N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90090266
8-ethoxy-2-methyl-N-[(3R,4S)-4-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane
CID 162253684
4-[(8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 154474868
8-ethoxy-2-methyl-N-(2-phenoxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 90090368
8-ethoxy-2-methyl-N-(4-pyrrolidin-1-ylphenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 110659994
8-ethoxy-2-methyl-N-(1-methylsulfonylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 90090260
8-ethoxy-2-methyl-N-[(3S)-1-sulfamoylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 90090244

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 147775711) is N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide is CCOc1cccn2c(C(=O)NC3(C#N)COC(C)(C)OC3)c(C)nc12.
What is the InChIKey of N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is HGUJUKOXYQUUIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O4/c1-5-24-13-7-6-8-22-14(12(2)20-15(13)22)16(23)21-18(9-19)10-25-17(3,4)26-11-18/h6-8H,5,10-11H2,1-4H3,(H,21,23).
What are the key properties of N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 358.40 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 147775711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).