N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide

C22H18N4O4 — CID 18225194

IUPACN-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide
SMILESCc1ccc2nc(-c3ccccc3)c(NC(=O)COc3ccc([N+](=O)[O-])cc3)n2c1
InChIInChI=1S/C22H18N4O4/c1-15-7-12-19-23-21(16-5-3-2-4-6-16)22(25(19)13-15)24-20(27)14-30-18-10-8-17(9-11-18)26(28)29/h2-13H,14H2,1H3,(H,24,27)
InChIKeyCGWLLYNLZYMTOE-UHFFFAOYSA-N
MW402.41 g/mol
LogP4.24
Rot. Bonds6

About N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide

N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide (PubChem CID 18225194) has the molecular formula C22H18N4O4 and a molecular weight of 402.41 g/mol. Its IUPAC name is N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide.

Molecular Properties

Compound NameN-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide
PubChem CID18225194
Molecular FormulaC22H18N4O4
Molecular Weight402.41 g/mol
Exact Mass402.13
IUPAC NameN-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide
SMILESCc1ccc2nc(-c3ccccc3)c(NC(=O)COc3ccc([N+](=O)[O-])cc3)n2c1
InChIInChI=1S/C22H18N4O4/c1-15-7-12-19-23-21(16-5-3-2-4-6-16)22(25(19)13-15)24-20(27)14-30-18-10-8-17(9-11-18)26(28)29/h2-13H,14H2,1H3,(H,24,27)
InChIKeyCGWLLYNLZYMTOE-UHFFFAOYSA-N
XLogP4.24
TPSA98.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.41
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(2-propoxyphenoxy)acetamide
CID 16559413
2-methoxy-N-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
CID 42881672
N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-phenoxyacetamide
CID 3351755
N-[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenoxyacetamide
CID 42694072
N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-(4-nitrophenoxy)acetamide
CID 12525792
N-(4,5-diphenyl-1,3-thiazol-2-yl)-2-(4-nitrophenoxy)acetamide
CID 18279241
2-(2-methoxy-4-prop-2-enylphenoxy)-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 16559418
N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-phenoxypropanamide
CID 18272044
2-(4-nitrophenoxy)-N-phenylacetamide
CID 923397
N-(2-methylphenyl)-2-(4-nitrophenoxy)acetamide
CID 2787243
4-(1,3-benzothiazol-2-ylsulfanyl)-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)butanamide
CID 16559405
3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 18271086

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide?
The IUPAC name of N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide (CID 18225194) is N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide.
What is the SMILES notation for N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide?
The canonical SMILES for N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide is Cc1ccc2nc(-c3ccccc3)c(NC(=O)COc3ccc([N+](=O)[O-])cc3)n2c1.
What is the InChIKey of N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide?
The InChIKey is CGWLLYNLZYMTOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O4/c1-15-7-12-19-23-21(16-5-3-2-4-6-16)22(25(19)13-15)24-20(27)14-30-18-10-8-17(9-11-18)26(28)29/h2-13H,14H2,1H3,(H,24,27).
What are the key properties of N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide?
N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide has a molecular weight of 402.41 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide is sourced from PubChem (CID 18225194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).