1-ethyl-6-oxopyridine-3-carboxamide

C8H10N2O2 — CID 12791799

IUPAC1-ethyl-6-oxopyridine-3-carboxamide
SMILESCCn1cc(C(N)=O)ccc1=O
InChIInChI=1S/C8H10N2O2/c1-2-10-5-6(8(9)12)3-4-7(10)11/h3-5H,2H2,1H3,(H2,9,12)
InChIKeyMGUWATZJZJNEBJ-UHFFFAOYSA-N
MW166.18 g/mol
LogP-0.03
Rot. Bonds2

About 1-ethyl-6-oxopyridine-3-carboxamide

1-ethyl-6-oxopyridine-3-carboxamide (PubChem CID 12791799) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 1-ethyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-6-oxopyridine-3-carboxamide
PubChem CID12791799
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name1-ethyl-6-oxopyridine-3-carboxamide
SMILESCCn1cc(C(N)=O)ccc1=O
InChIInChI=1S/C8H10N2O2/c1-2-10-5-6(8(9)12)3-4-7(10)11/h3-5H,2H2,1H3,(H2,9,12)
InChIKeyMGUWATZJZJNEBJ-UHFFFAOYSA-N
XLogP-0.03
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-ethyl-6-oxopyridine-3-carboxamide (CID 12791799) is 1-ethyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-ethyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-ethyl-6-oxopyridine-3-carboxamide is CCn1cc(C(N)=O)ccc1=O.
What is the InChIKey of 1-ethyl-6-oxopyridine-3-carboxamide?
The InChIKey is MGUWATZJZJNEBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-2-10-5-6(8(9)12)3-4-7(10)11/h3-5H,2H2,1H3,(H2,9,12).
What are the key properties of 1-ethyl-6-oxopyridine-3-carboxamide?
1-ethyl-6-oxopyridine-3-carboxamide has a molecular weight of 166.18 g/mol, XLogP of -0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 12791799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).