N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide

C15H14N2O3 — CID 15239996

IUPACN-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ccc(OCc2ccccc2)c(C=O)n1
InChIInChI=1S/C15H14N2O3/c1-11(19)16-15-8-7-14(13(9-18)17-15)20-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17,19)
InChIKeyAHXNMDJXKLZNKK-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.43
Rot. Bonds5

About N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide

N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide (PubChem CID 15239996) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide
PubChem CID15239996
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC NameN-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ccc(OCc2ccccc2)c(C=O)n1
InChIInChI=1S/C15H14N2O3/c1-11(19)16-15-8-7-14(13(9-18)17-15)20-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17,19)
InChIKeyAHXNMDJXKLZNKK-UHFFFAOYSA-N
XLogP2.43
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide?
The IUPAC name of N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide (CID 15239996) is N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide.
What is the SMILES notation for N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide?
The canonical SMILES for N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide is CC(=O)Nc1ccc(OCc2ccccc2)c(C=O)n1.
What is the InChIKey of N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide?
The InChIKey is AHXNMDJXKLZNKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-11(19)16-15-8-7-14(13(9-18)17-15)20-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17,19).
What are the key properties of N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide?
N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide has a molecular weight of 270.29 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide is sourced from PubChem (CID 15239996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).