N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide

C16H19N3O2 — CID 107261353

IUPACN-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NCCc2ccccc2OC)cn1
InChIInChI=1S/C16H19N3O2/c1-17-15-8-7-13(11-19-15)16(20)18-10-9-12-5-3-4-6-14(12)21-2/h3-8,11H,9-10H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyGMECYRJOEQARDI-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.10
Rot. Bonds6

About N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide

N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide (PubChem CID 107261353) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
PubChem CID107261353
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NCCc2ccccc2OC)cn1
InChIInChI=1S/C16H19N3O2/c1-17-15-8-7-13(11-19-15)16(20)18-10-9-12-5-3-4-6-14(12)21-2/h3-8,11H,9-10H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyGMECYRJOEQARDI-UHFFFAOYSA-N
XLogP2.10
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide (CID 107261353) is N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide is CNc1ccc(C(=O)NCCc2ccccc2OC)cn1.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide?
The InChIKey is GMECYRJOEQARDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-17-15-8-7-13(11-19-15)16(20)18-10-9-12-5-3-4-6-14(12)21-2/h3-8,11H,9-10H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide?
N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 107261353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).