2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide

C11H14N2O2 — CID 175781996

IUPAC2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide
SMILESC=C(C)c1c(C)[nH]c(C)c(C(N)=O)c1=O
InChIInChI=1S/C11H14N2O2/c1-5(2)8-6(3)13-7(4)9(10(8)14)11(12)15/h1H2,2-4H3,(H2,12,15)(H,13,14)
InChIKeyJAOPNWUWEKRFPM-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.12
Rot. Bonds2

About 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide

2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide (PubChem CID 175781996) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide
PubChem CID175781996
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide
SMILESC=C(C)c1c(C)[nH]c(C)c(C(N)=O)c1=O
InChIInChI=1S/C11H14N2O2/c1-5(2)8-6(3)13-7(4)9(10(8)14)11(12)15/h1H2,2-4H3,(H2,12,15)(H,13,14)
InChIKeyJAOPNWUWEKRFPM-UHFFFAOYSA-N
XLogP1.12
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-carbamoyl-2,6-dimethyl-4-oxo-1H-pyridine-3-carboxylic acid
CID 164905034
3-methyl-5-sulfanylidene-1,2-dihydropyrazole-4-carboxamide
CID 118628163
2-fluoro-6-methyl-4-prop-1-en-2-ylbenzamide
CID 177031736
4-methyl-5-prop-1-en-2-yl-1,3-dihydroimidazol-2-one
CID 175626074
4-carbamoyl-3-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid
CID 71756338
4-ethyl-2-methyl-5-prop-1-en-2-yl-1H-pyrrole-3-carboxylic acid
CID 143917610
3,5-diacetyl-4,6-dimethyl-1H-pyridin-2-one
CID 15555017
2,6-dibromo-3-fluoro-5-prop-1-en-2-yl-1H-pyridin-4-one
CID 155780525
2-methyl-5-(5-methylfuran-2-yl)-4-oxo-1H-pyridine-3-carboxamide
CID 175841744
3,5,6-tris(prop-1-en-2-yl)benzene-1,2,4-tricarboxylate
CID 19973295
2-methyl-5-(3-methylthiophen-2-yl)-4-oxo-1H-pyridine-3-carboxamide
CID 175841861
5-[(E)-N-hydroxy-C-methylcarbonimidoyl]-6-methyl-1H-pyrimidine-2,4-dione
CID 137262645

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide?
The IUPAC name of 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide (CID 175781996) is 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide?
The canonical SMILES for 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide is C=C(C)c1c(C)[nH]c(C)c(C(N)=O)c1=O.
What is the InChIKey of 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide?
The InChIKey is JAOPNWUWEKRFPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-5(2)8-6(3)13-7(4)9(10(8)14)11(12)15/h1H2,2-4H3,(H2,12,15)(H,13,14).
What are the key properties of 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide?
2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide has a molecular weight of 206.24 g/mol, XLogP of 1.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-oxo-5-prop-1-en-2-yl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 175781996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).