2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide

C16H15N3O2 — CID 168521174

IUPAC2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide
SMILESN#CCC(=O)Nc1ccccc1OCCc1ccccn1
InChIInChI=1S/C16H15N3O2/c17-10-8-16(20)19-14-6-1-2-7-15(14)21-12-9-13-5-3-4-11-18-13/h1-7,11H,8-9,12H2,(H,19,20)
InChIKeyYHSZHGUPFGOFQN-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.56
Rot. Bonds6

About 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide

2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide (PubChem CID 168521174) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide
PubChem CID168521174
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide
SMILESN#CCC(=O)Nc1ccccc1OCCc1ccccn1
InChIInChI=1S/C16H15N3O2/c17-10-8-16(20)19-14-6-1-2-7-15(14)21-12-9-13-5-3-4-11-18-13/h1-7,11H,8-9,12H2,(H,19,20)
InChIKeyYHSZHGUPFGOFQN-UHFFFAOYSA-N
XLogP2.56
TPSA75.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyano-N-[2-(3-phenylpropoxy)phenyl]acetamide
CID 168520539
2-cyano-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 168520948
4-acetyl-N-[2-(2-pyridin-2-ylethoxy)phenyl]piperazine-1-carboxamide
CID 72933823
2-cyano-N-(2-pyridin-3-yloxyphenyl)acetamide
CID 168521073
1,1-dioxo-N-[2-(2-pyridin-2-ylethoxy)phenyl]-1,4-thiazinane-4-carboxamide
CID 72875793
2-cyano-N-(pyridin-2-ylmethyl)acetamide
CID 2799775
N-(2-aminophenyl)-2-(2-pyridin-2-ylethoxy)acetamide
CID 29006236
2-cyano-N-[3-fluoro-4-(pyridin-2-ylmethoxy)phenyl]acetamide
CID 168523388
2-[2-(2-fluorophenoxy)ethyl]pyridine
CID 64765449
N'-(2-ethoxyphenyl)-N-(pyridin-2-ylmethyl)propanediamide
CID 108947531
pyridin-2-ylmethyl 2-cyanoacetate
CID 135348662
2-pyridin-2-ylethyl cyanate
CID 21195134

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide?
The IUPAC name of 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide (CID 168521174) is 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide.
What is the SMILES notation for 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide?
The canonical SMILES for 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide is N#CCC(=O)Nc1ccccc1OCCc1ccccn1.
What is the InChIKey of 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide?
The InChIKey is YHSZHGUPFGOFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c17-10-8-16(20)19-14-6-1-2-7-15(14)21-12-9-13-5-3-4-11-18-13/h1-7,11H,8-9,12H2,(H,19,20).
What are the key properties of 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide?
2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide has a molecular weight of 281.32 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-[2-(2-pyridin-2-ylethoxy)phenyl]acetamide is sourced from PubChem (CID 168521174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).