4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide

C10H11N3O2 — CID 142768975

IUPAC4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCc1c(C)[nH]c(=O)c(C(N)=O)c1C#N
InChIInChI=1S/C10H11N3O2/c1-3-6-5(2)13-10(15)8(9(12)14)7(6)4-11/h3H2,1-2H3,(H2,12,14)(H,13,15)
InChIKeyLWEORHJBKDDZRU-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.22
Rot. Bonds2

About 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide

4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 142768975) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID142768975
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCc1c(C)[nH]c(=O)c(C(N)=O)c1C#N
InChIInChI=1S/C10H11N3O2/c1-3-6-5(2)13-10(15)8(9(12)14)7(6)4-11/h3H2,1-2H3,(H2,12,14)(H,13,15)
InChIKeyLWEORHJBKDDZRU-UHFFFAOYSA-N
XLogP0.22
TPSA99.74 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 142768975) is 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide is CCc1c(C)[nH]c(=O)c(C(N)=O)c1C#N.
What is the InChIKey of 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is LWEORHJBKDDZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-3-6-5(2)13-10(15)8(9(12)14)7(6)4-11/h3H2,1-2H3,(H2,12,14)(H,13,15).
What are the key properties of 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 205.22 g/mol, XLogP of 0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-5-ethyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 142768975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).