2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine

C16H15N3O3 — CID 82356316

IUPAC2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine
SMILESCOc1ccc(OC)c(-c2nc3c(C)cccn3c2N=O)c1
InChIInChI=1S/C16H15N3O3/c1-10-5-4-8-19-15(10)17-14(16(19)18-20)12-9-11(21-2)6-7-13(12)22-3/h4-9H,1-3H3
InChIKeyOMJHAJJKATWSLU-UHFFFAOYSA-N
MW297.31 g/mol
LogP3.72
Rot. Bonds4

About 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine

2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine (PubChem CID 82356316) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine
PubChem CID82356316
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC Name2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine
SMILESCOc1ccc(OC)c(-c2nc3c(C)cccn3c2N=O)c1
InChIInChI=1S/C16H15N3O3/c1-10-5-4-8-19-15(10)17-14(16(19)18-20)12-9-11(21-2)6-7-13(12)22-3/h4-9H,1-3H3
InChIKeyOMJHAJJKATWSLU-UHFFFAOYSA-N
XLogP3.72
TPSA65.19 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-ethoxy-5-methylphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356325
1-[2-(2,5-dimethoxyphenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
CID 39146199
2-(3,4-dimethylphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356291
2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356383
N,N-dimethyl-4-(8-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)aniline
CID 82356328
2-(2-methoxyphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356243
2-(2,5-dimethoxyphenyl)-N-(2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 4271217
8-methyl-3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridine
CID 82356334
2-(3,4-dimethoxyphenyl)-8-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 2758451
2-(4-methoxy-2-methylphenyl)-6-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356459
2-(4-methoxy-2,6-dimethylphenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 82355792
3-(2,5-dimethoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 46539218

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine?
The IUPAC name of 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine (CID 82356316) is 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine is COc1ccc(OC)c(-c2nc3c(C)cccn3c2N=O)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine?
The InChIKey is OMJHAJJKATWSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-10-5-4-8-19-15(10)17-14(16(19)18-20)12-9-11(21-2)6-7-13(12)22-3/h4-9H,1-3H3.
What are the key properties of 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine?
2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine has a molecular weight of 297.31 g/mol, XLogP of 3.72, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine is sourced from PubChem (CID 82356316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).