2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide

C15H16N2O2 — CID 84580463

IUPAC2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide
SMILESCOc1cc(C(=O)NCCc2ccccc2)ccn1
InChIInChI=1S/C15H16N2O2/c1-19-14-11-13(8-10-16-14)15(18)17-9-7-12-5-3-2-4-6-12/h2-6,8,10-11H,7,9H2,1H3,(H,17,18)
InChIKeyYBPJXSGQFMCBBU-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.06
Rot. Bonds5

About 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide

2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide (PubChem CID 84580463) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide
PubChem CID84580463
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide
SMILESCOc1cc(C(=O)NCCc2ccccc2)ccn1
InChIInChI=1S/C15H16N2O2/c1-19-14-11-13(8-10-16-14)15(18)17-9-7-12-5-3-2-4-6-12/h2-6,8,10-11H,7,9H2,1H3,(H,17,18)
InChIKeyYBPJXSGQFMCBBU-UHFFFAOYSA-N
XLogP2.06
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide (CID 84580463) is 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide is COc1cc(C(=O)NCCc2ccccc2)ccn1.
What is the InChIKey of 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide?
The InChIKey is YBPJXSGQFMCBBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-19-14-11-13(8-10-16-14)15(18)17-9-7-12-5-3-2-4-6-12/h2-6,8,10-11H,7,9H2,1H3,(H,17,18).
What are the key properties of 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide?
2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 84580463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).