2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide

C18H15N5O2 — CID 75479938

IUPAC2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
SMILESCc1nccn1-c1ncccc1NC(=O)COc1cccc(C#N)c1
InChIInChI=1S/C18H15N5O2/c1-13-20-8-9-23(13)18-16(6-3-7-21-18)22-17(24)12-25-15-5-2-4-14(10-15)11-19/h2-10H,12H2,1H3,(H,22,24)
InChIKeyZMNAPKWRCPRGTJ-UHFFFAOYSA-N
MW333.35 g/mol
LogP2.46
Rot. Bonds5

About 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide

2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide (PubChem CID 75479938) has the molecular formula C18H15N5O2 and a molecular weight of 333.35 g/mol. Its IUPAC name is 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
PubChem CID75479938
Molecular FormulaC18H15N5O2
Molecular Weight333.35 g/mol
Exact Mass333.12
IUPAC Name2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
SMILESCc1nccn1-c1ncccc1NC(=O)COc1cccc(C#N)c1
InChIInChI=1S/C18H15N5O2/c1-13-20-8-9-23(13)18-16(6-3-7-21-18)22-17(24)12-25-15-5-2-4-14(10-15)11-19/h2-10H,12H2,1H3,(H,22,24)
InChIKeyZMNAPKWRCPRGTJ-UHFFFAOYSA-N
XLogP2.46
TPSA92.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.35
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-aminoethoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 79474016
2-(2-fluorophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 51092996
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 47254863
2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide
CID 2591399
2-(3-cyanophenoxy)-N-(2-fluoro-4-methylphenyl)acetamide
CID 7964016
N-(2-bromo-4-methylphenyl)-2-(3-cyanophenoxy)acetamide
CID 2591410
4-hydroxy-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]pentanamide
CID 79203902
3-amino-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide
CID 54861937
2-(cyclopropylamino)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 60927836
4-(methylamino)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]butanamide;dihydrochloride
CID 119847732
2-(3-cyanophenoxy)-N-(4-methyl-2-nitrophenyl)acetamide
CID 4789629
N-(3-chlorophenyl)-2-(3-cyanophenoxy)acetamide
CID 8933252

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide?
The IUPAC name of 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide (CID 75479938) is 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide is Cc1nccn1-c1ncccc1NC(=O)COc1cccc(C#N)c1.
What is the InChIKey of 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide?
The InChIKey is ZMNAPKWRCPRGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O2/c1-13-20-8-9-23(13)18-16(6-3-7-21-18)22-17(24)12-25-15-5-2-4-14(10-15)11-19/h2-10H,12H2,1H3,(H,22,24).
What are the key properties of 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide?
2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide has a molecular weight of 333.35 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyanophenoxy)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide is sourced from PubChem (CID 75479938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).