6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane

C10H15ClN2O — CID 170981052

IUPAC6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane
SMILESCC.CNC(=O)c1ccc(C)c(Cl)n1
InChIInChI=1S/C8H9ClN2O.C2H6/c1-5-3-4-6(8(12)10-2)11-7(5)9;1-2/h3-4H,1-2H3,(H,10,12);1-2H3
InChIKeyNMLDZZJEHYBZDQ-UHFFFAOYSA-N
MW214.70 g/mol
LogP2.43
Rot. Bonds1

About 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane

6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane (PubChem CID 170981052) has the molecular formula C10H15ClN2O and a molecular weight of 214.70 g/mol. Its IUPAC name is 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane.

Molecular Properties

Compound Name6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane
PubChem CID170981052
Molecular FormulaC10H15ClN2O
Molecular Weight214.70 g/mol
Exact Mass214.09
IUPAC Name6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane
SMILESCC.CNC(=O)c1ccc(C)c(Cl)n1
InChIInChI=1S/C8H9ClN2O.C2H6/c1-5-3-4-6(8(12)10-2)11-7(5)9;1-2/h3-4H,1-2H3,(H,10,12);1-2H3
InChIKeyNMLDZZJEHYBZDQ-UHFFFAOYSA-N
XLogP2.43
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.70
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N,5,6-trimethylpyridine-2-carboxamide
CID 131113985
6-cyano-N,5-dimethylpyridine-2-carboxamide
CID 170981219
6-chloro-N-methyl-5-piperidin-1-ylpyridine-2-carboxamide
CID 172815704
5-ethyl-N,6-dimethylpyridine-2-carboxamide
CID 166088986
5-(aminomethyl)-N,6-dimethylpyridine-2-carboxamide
CID 82503638
4-chloro-N,6-dimethylpyridine-2-carboxamide
CID 129104219
1-(2-chloro-5-methylpyrimidin-4-yl)-N-methylpyrazole-3-carboxamide
CID 79073921
5-(bromomethyl)-N-methylpyridine-2-carboxamide
CID 166088325
CID 178148091
CID 178148091
2-chloro-6-(6-chloro-5-methyl-2-pyridinyl)-3-methylpyridine
CID 25228536
5-amino-6-methoxy-N-methylpyridine-2-carboxamide
CID 86726461
6-chloro-N-methyl-5-[[2-[[2-(triazol-1-yl)acetyl]amino]acetyl]amino]pyridine-2-carboxamide
CID 176575728

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane?
The IUPAC name of 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane (CID 170981052) is 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane.
What is the SMILES notation for 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane?
The canonical SMILES for 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane is CC.CNC(=O)c1ccc(C)c(Cl)n1.
What is the InChIKey of 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane?
The InChIKey is NMLDZZJEHYBZDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O.C2H6/c1-5-3-4-6(8(12)10-2)11-7(5)9;1-2/h3-4H,1-2H3,(H,10,12);1-2H3.
What are the key properties of 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane?
6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane has a molecular weight of 214.70 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N,5-dimethylpyridine-2-carboxamide;ethane is sourced from PubChem (CID 170981052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).