N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide

C16H18N2O2 — CID 107261843

IUPACN-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide
SMILESCCN(CCc1ccccc1)C(=O)c1cccc(=O)[nH]1
InChIInChI=1S/C16H18N2O2/c1-2-18(12-11-13-7-4-3-5-8-13)16(20)14-9-6-10-15(19)17-14/h3-10H,2,11-12H2,1H3,(H,17,19)
InChIKeyIQHYYNSUOVJJEE-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.08
Rot. Bonds5

About N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide

N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide (PubChem CID 107261843) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide
PubChem CID107261843
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide
SMILESCCN(CCc1ccccc1)C(=O)c1cccc(=O)[nH]1
InChIInChI=1S/C16H18N2O2/c1-2-18(12-11-13-7-4-3-5-8-13)16(20)14-9-6-10-15(19)17-14/h3-10H,2,11-12H2,1H3,(H,17,19)
InChIKeyIQHYYNSUOVJJEE-UHFFFAOYSA-N
XLogP2.08
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide?
The IUPAC name of N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide (CID 107261843) is N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide is CCN(CCc1ccccc1)C(=O)c1cccc(=O)[nH]1.
What is the InChIKey of N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide?
The InChIKey is IQHYYNSUOVJJEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-2-18(12-11-13-7-4-3-5-8-13)16(20)14-9-6-10-15(19)17-14/h3-10H,2,11-12H2,1H3,(H,17,19).
What are the key properties of N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide?
N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide has a molecular weight of 270.33 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-oxo-N-(2-phenylethyl)-1H-pyridine-2-carboxamide is sourced from PubChem (CID 107261843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).