2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine

C16H15N3O3 — CID 82356383

IUPAC2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine
SMILESCOc1ccc(-c2nc3cc(C)ccn3c2N=O)c(OC)c1
InChIInChI=1S/C16H15N3O3/c1-10-6-7-19-14(8-10)17-15(16(19)18-20)12-5-4-11(21-2)9-13(12)22-3/h4-9H,1-3H3
InChIKeyBJQBJEMOQNNFRN-UHFFFAOYSA-N
MW297.31 g/mol
LogP3.72
Rot. Bonds4

About 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine

2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine (PubChem CID 82356383) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine
PubChem CID82356383
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC Name2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine
SMILESCOc1ccc(-c2nc3cc(C)ccn3c2N=O)c(OC)c1
InChIInChI=1S/C16H15N3O3/c1-10-6-7-19-14(8-10)17-15(16(19)18-20)12-5-4-11(21-2)9-13(12)22-3/h4-9H,1-3H3
InChIKeyBJQBJEMOQNNFRN-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-(2,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 63617611
7-methyl-2-(4-methylphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 44726067
2-(4-methoxy-2-methylphenyl)-6-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356459
2-(2-methoxyphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356243
2-(2,5-dimethoxyphenyl)-8-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356316
7-methyl-3-nitroso-2-propan-2-ylimidazo[1,2-a]pyridine
CID 82356376
2-(4-methoxy-2,5-dimethylphenyl)-6-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356466
2-(2,3-dihydro-1H-inden-5-yl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356379
3-methoxy-N-[2-(4-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]benzamide
CID 4226621
3,5-dimethoxy-N-[2-(4-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]benzamide
CID 42693981
4-methoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide
CID 25038955
2-(4-methoxyphenyl)-8-methylpyrido[1,2-a]pyrimidin-4-one
CID 10730461

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine (CID 82356383) is 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine is COc1ccc(-c2nc3cc(C)ccn3c2N=O)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine?
The InChIKey is BJQBJEMOQNNFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-10-6-7-19-14(8-10)17-15(16(19)18-20)12-5-4-11(21-2)9-13(12)22-3/h4-9H,1-3H3.
What are the key properties of 2-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine?
2-(2,4-dimethoxyphenyl)-7-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-(2,4-dimethoxyphenyl)-7-methyl-3-nitrosoimidazo[1,2-a]pyridine is sourced from PubChem (CID 82356383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).