N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide

C17H16N4O3 — CID 90564820

IUPACN-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide
SMILESCOc1cccc(OCC(=O)Nc2ccc(-n3ccnc3)nc2)c1
InChIInChI=1S/C17H16N4O3/c1-23-14-3-2-4-15(9-14)24-11-17(22)20-13-5-6-16(19-10-13)21-8-7-18-12-21/h2-10,12H,11H2,1H3,(H,20,22)
InChIKeyGBAGXJBDUXFTJT-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.29
Rot. Bonds6

About N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide

N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide (PubChem CID 90564820) has the molecular formula C17H16N4O3 and a molecular weight of 324.34 g/mol. Its IUPAC name is N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide
PubChem CID90564820
Molecular FormulaC17H16N4O3
Molecular Weight324.34 g/mol
Exact Mass324.12
IUPAC NameN-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide
SMILESCOc1cccc(OCC(=O)Nc2ccc(-n3ccnc3)nc2)c1
InChIInChI=1S/C17H16N4O3/c1-23-14-3-2-4-15(9-14)24-11-17(22)20-13-5-6-16(19-10-13)21-8-7-18-12-21/h2-10,12H,11H2,1H3,(H,20,22)
InChIKeyGBAGXJBDUXFTJT-UHFFFAOYSA-N
XLogP2.29
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,5-dimethoxyphenyl)-2-(4-imidazol-1-ylphenoxy)acetamide
CID 4881019
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
N-(6-imidazol-1-yl-3-pyridinyl)butanamide
CID 35437719
2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
2-(3-ethoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 112977809
2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide
CID 60867461
N-(3-imidazol-1-ylphenyl)-2-methoxyacetamide
CID 47215494
N-(3-amino-4-ethylphenyl)-2-(3-methoxyphenoxy)acetamide
CID 28867334
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-imidazol-1-ylphenyl)acetamide
CID 51118112
N-(6-imidazol-1-yl-3-pyridinyl)-4-(methylamino)butanamide;dihydrochloride
CID 119846827
ethyl 2-[(6-imidazol-1-yl-3-pyridinyl)amino]-2-oxoacetate
CID 90564814
N-(6-imidazol-1-yl-3-pyridinyl)-2-methylpropanamide
CID 35437698

Frequently Asked Questions

What is the IUPAC name of N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide?
The IUPAC name of N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide (CID 90564820) is N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide?
The canonical SMILES for N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide is COc1cccc(OCC(=O)Nc2ccc(-n3ccnc3)nc2)c1.
What is the InChIKey of N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide?
The InChIKey is GBAGXJBDUXFTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3/c1-23-14-3-2-4-15(9-14)24-11-17(22)20-13-5-6-16(19-10-13)21-8-7-18-12-21/h2-10,12H,11H2,1H3,(H,20,22).
What are the key properties of N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide?
N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide has a molecular weight of 324.34 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-imidazol-1-yl-3-pyridinyl)-2-(3-methoxyphenoxy)acetamide is sourced from PubChem (CID 90564820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).