5-formyl-4-methylpyridine-2-carboxamide

C8H8N2O2 — CID 151701990

IUPAC5-formyl-4-methylpyridine-2-carboxamide
SMILESCc1cc(C(N)=O)ncc1C=O
InChIInChI=1S/C8H8N2O2/c1-5-2-7(8(9)12)10-3-6(5)4-11/h2-4H,1H3,(H2,9,12)
InChIKeyREUMVPQUEGGHTI-UHFFFAOYSA-N
MW164.16 g/mol
LogP0.30
Rot. Bonds2

About 5-formyl-4-methylpyridine-2-carboxamide

5-formyl-4-methylpyridine-2-carboxamide (PubChem CID 151701990) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is 5-formyl-4-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-formyl-4-methylpyridine-2-carboxamide
PubChem CID151701990
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Name5-formyl-4-methylpyridine-2-carboxamide
SMILESCc1cc(C(N)=O)ncc1C=O
InChIInChI=1S/C8H8N2O2/c1-5-2-7(8(9)12)10-3-6(5)4-11/h2-4H,1H3,(H2,9,12)
InChIKeyREUMVPQUEGGHTI-UHFFFAOYSA-N
XLogP0.30
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4,5-dimethylpyridine-2-carboxamide
CID 158335176
4-(hydroxymethyl)-5-methylpyridine-2-carboxamide
CID 163653918
4-methyl-6-pyrrolidin-1-ylpyridine-3-carbaldehyde
CID 102545487
6-[difluoro(phosphanyl)methyl]-4-methylpyridine-3-carbaldehyde
CID 154670408
5-formyl-N-[3-[3-[2-(5-formyl-4-methyl-2-pyridinyl)-2-oxoethyl]-2-methylphenyl]-2-methylphenyl]-4-methylpyridine-2-carboxamide
CID 158592210
6-(dipropylamino)-4-methylpyridine-3-carbaldehyde
CID 102545342
4-(4-formyl-2,5-dimethylphenyl)piperazine-1-carboxamide
CID 4742190
methyl 2-fluoro-4-formyl-5-methylbenzoate
CID 90317126
4-formyl-2-hydroxy-5-methylbenzoic acid
CID 170993830
5-methylpyridazine-3-carboxamide
CID 68633720
1-(5-formyl-2-methylphenyl)pyrazole-4-carboxamide
CID 105405310
1-methylpyrrolo[2,3-c]pyridine-5-carboxamide;hydrochloride
CID 68813268

Frequently Asked Questions

What is the IUPAC name of 5-formyl-4-methylpyridine-2-carboxamide?
The IUPAC name of 5-formyl-4-methylpyridine-2-carboxamide (CID 151701990) is 5-formyl-4-methylpyridine-2-carboxamide.
What is the SMILES notation for 5-formyl-4-methylpyridine-2-carboxamide?
The canonical SMILES for 5-formyl-4-methylpyridine-2-carboxamide is Cc1cc(C(N)=O)ncc1C=O.
What is the InChIKey of 5-formyl-4-methylpyridine-2-carboxamide?
The InChIKey is REUMVPQUEGGHTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-5-2-7(8(9)12)10-3-6(5)4-11/h2-4H,1H3,(H2,9,12).
What are the key properties of 5-formyl-4-methylpyridine-2-carboxamide?
5-formyl-4-methylpyridine-2-carboxamide has a molecular weight of 164.16 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-formyl-4-methylpyridine-2-carboxamide is sourced from PubChem (CID 151701990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).