N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide

C15H16N2O2 — CID 174990396

IUPACN-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide
SMILESCCNC(=O)c1ccc(-c2ccc(OC)cc2)cn1
InChIInChI=1S/C15H16N2O2/c1-3-16-15(18)14-9-6-12(10-17-14)11-4-7-13(19-2)8-5-11/h4-10H,3H2,1-2H3,(H,16,18)
InChIKeyYQAOKLSRPFSPKZ-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.51
Rot. Bonds4

About N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide

N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 174990396) has the molecular formula C15H16N2O2 and a molecular weight of 256.30 g/mol. Its IUPAC name is N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide
PubChem CID174990396
Molecular FormulaC15H16N2O2
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC NameN-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide
SMILESCCNC(=O)c1ccc(-c2ccc(OC)cc2)cn1
InChIInChI=1S/C15H16N2O2/c1-3-16-15(18)14-9-6-12(10-17-14)11-4-7-13(19-2)8-5-11/h4-10H,3H2,1-2H3,(H,16,18)
InChIKeyYQAOKLSRPFSPKZ-UHFFFAOYSA-N
XLogP2.51
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide (CID 174990396) is N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide is CCNC(=O)c1ccc(-c2ccc(OC)cc2)cn1.
What is the InChIKey of N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is YQAOKLSRPFSPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-3-16-15(18)14-9-6-12(10-17-14)11-4-7-13(19-2)8-5-11/h4-10H,3H2,1-2H3,(H,16,18).
What are the key properties of N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide?
N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide has a molecular weight of 256.30 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(4-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 174990396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).