N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide

C15H16N2O2 — CID 84560046

IUPACN-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1ncccc1OCc1ccccc1C
InChIInChI=1S/C15H16N2O2/c1-11-6-3-4-7-13(11)10-19-14-8-5-9-16-15(14)17-12(2)18/h3-9H,10H2,1-2H3,(H,16,17,18)
InChIKeyBIPGUQSXGLTSBM-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.93
Rot. Bonds4

About N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide

N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide (PubChem CID 84560046) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide
PubChem CID84560046
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1ncccc1OCc1ccccc1C
InChIInChI=1S/C15H16N2O2/c1-11-6-3-4-7-13(11)10-19-14-8-5-9-16-15(14)17-12(2)18/h3-9H,10H2,1-2H3,(H,16,17,18)
InChIKeyBIPGUQSXGLTSBM-UHFFFAOYSA-N
XLogP2.93
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide?
The IUPAC name of N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide (CID 84560046) is N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide?
The canonical SMILES for N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide is CC(=O)Nc1ncccc1OCc1ccccc1C.
What is the InChIKey of N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide?
The InChIKey is BIPGUQSXGLTSBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-11-6-3-4-7-13(11)10-19-14-8-5-9-16-15(14)17-12(2)18/h3-9H,10H2,1-2H3,(H,16,17,18).
What are the key properties of N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide?
N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide has a molecular weight of 256.31 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide is sourced from PubChem (CID 84560046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).