6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide

C11H17N3O2 — CID 173079352

IUPAC6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide
SMILESCCOCCN(C)c1cccc(C(N)=O)n1
InChIInChI=1S/C11H17N3O2/c1-3-16-8-7-14(2)10-6-4-5-9(13-10)11(12)15/h4-6H,3,7-8H2,1-2H3,(H2,12,15)
InChIKeyNSGLBHZEKBNNBK-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.65
Rot. Bonds6

About 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide

6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide (PubChem CID 173079352) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide
PubChem CID173079352
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide
SMILESCCOCCN(C)c1cccc(C(N)=O)n1
InChIInChI=1S/C11H17N3O2/c1-3-16-8-7-14(2)10-6-4-5-9(13-10)11(12)15/h4-6H,3,7-8H2,1-2H3,(H2,12,15)
InChIKeyNSGLBHZEKBNNBK-UHFFFAOYSA-N
XLogP0.65
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide?
The IUPAC name of 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide (CID 173079352) is 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide?
The canonical SMILES for 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide is CCOCCN(C)c1cccc(C(N)=O)n1.
What is the InChIKey of 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide?
The InChIKey is NSGLBHZEKBNNBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-3-16-8-7-14(2)10-6-4-5-9(13-10)11(12)15/h4-6H,3,7-8H2,1-2H3,(H2,12,15).
What are the key properties of 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide?
6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-ethoxyethyl(methyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 173079352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).