6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide

C11H17N3O2 — CID 25294409

IUPAC6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCCN(CC)Cc1ccc(C(N)=O)c(=O)[nH]1
InChIInChI=1S/C11H17N3O2/c1-3-14(4-2)7-8-5-6-9(10(12)15)11(16)13-8/h5-6H,3-4,7H2,1-2H3,(H2,12,15)(H,13,16)
InChIKeyGYYVRXXKDOFWMI-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.32
Rot. Bonds5

About 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide

6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 25294409) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID25294409
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCCN(CC)Cc1ccc(C(N)=O)c(=O)[nH]1
InChIInChI=1S/C11H17N3O2/c1-3-14(4-2)7-8-5-6-9(10(12)15)11(16)13-8/h5-6H,3-4,7H2,1-2H3,(H2,12,15)(H,13,16)
InChIKeyGYYVRXXKDOFWMI-UHFFFAOYSA-N
XLogP0.32
TPSA79.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide (CID 25294409) is 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide is CCN(CC)Cc1ccc(C(N)=O)c(=O)[nH]1.
What is the InChIKey of 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is GYYVRXXKDOFWMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-3-14(4-2)7-8-5-6-9(10(12)15)11(16)13-8/h5-6H,3-4,7H2,1-2H3,(H2,12,15)(H,13,16).
What are the key properties of 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide?
6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylaminomethyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 25294409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).