4,5-dimethylpyridine-2-carboxamide

C8H10N2O — CID 158335176

IUPAC4,5-dimethylpyridine-2-carboxamide
SMILESCc1cnc(C(N)=O)cc1C
InChIInChI=1S/C8H10N2O/c1-5-3-7(8(9)11)10-4-6(5)2/h3-4H,1-2H3,(H2,9,11)
InChIKeyGQMLSBDRHQRRDJ-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.80
Rot. Bonds1

About 4,5-dimethylpyridine-2-carboxamide

4,5-dimethylpyridine-2-carboxamide (PubChem CID 158335176) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 4,5-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4,5-dimethylpyridine-2-carboxamide
PubChem CID158335176
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name4,5-dimethylpyridine-2-carboxamide
SMILESCc1cnc(C(N)=O)cc1C
InChIInChI=1S/C8H10N2O/c1-5-3-7(8(9)11)10-4-6(5)2/h3-4H,1-2H3,(H2,9,11)
InChIKeyGQMLSBDRHQRRDJ-UHFFFAOYSA-N
XLogP0.80
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5-dimethylpyridine-2-carboxamide?
The IUPAC name of 4,5-dimethylpyridine-2-carboxamide (CID 158335176) is 4,5-dimethylpyridine-2-carboxamide.
What is the SMILES notation for 4,5-dimethylpyridine-2-carboxamide?
The canonical SMILES for 4,5-dimethylpyridine-2-carboxamide is Cc1cnc(C(N)=O)cc1C.
What is the InChIKey of 4,5-dimethylpyridine-2-carboxamide?
The InChIKey is GQMLSBDRHQRRDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-5-3-7(8(9)11)10-4-6(5)2/h3-4H,1-2H3,(H2,9,11).
What are the key properties of 4,5-dimethylpyridine-2-carboxamide?
4,5-dimethylpyridine-2-carboxamide has a molecular weight of 150.18 g/mol, XLogP of 0.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 158335176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).