3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide

C8H10ClN3O — CID 169154520

IUPAC3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide
SMILESCNC(=O)c1cc(C)nc(Cl)c1N
InChIInChI=1S/C8H10ClN3O/c1-4-3-5(8(13)11-2)6(10)7(9)12-4/h3H,10H2,1-2H3,(H,11,13)
InChIKeyYFIMYEBNBGFCIW-UHFFFAOYSA-N
MW199.64 g/mol
LogP0.99
Rot. Bonds1

About 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide

3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide (PubChem CID 169154520) has the molecular formula C8H10ClN3O and a molecular weight of 199.64 g/mol. Its IUPAC name is 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide.

Molecular Properties

Compound Name3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide
PubChem CID169154520
Molecular FormulaC8H10ClN3O
Molecular Weight199.64 g/mol
Exact Mass199.05
IUPAC Name3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide
SMILESCNC(=O)c1cc(C)nc(Cl)c1N
InChIInChI=1S/C8H10ClN3O/c1-4-3-5(8(13)11-2)6(10)7(9)12-4/h3H,10H2,1-2H3,(H,11,13)
InChIKeyYFIMYEBNBGFCIW-UHFFFAOYSA-N
XLogP0.99
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-chloro-N-methylpyridine-4-carboxamide
CID 114921748
4-chloro-N,6-dimethylpyridine-2-carboxamide
CID 129104219
4-amino-N,6-dimethylpyridine-3-carboxamide
CID 81236701
2-chloro-5-fluoro-N,4-dimethylbenzamide
CID 116827653
2-chloro-5-fluoro-N-methylpyridine-3-carboxamide
CID 103893144
2-amino-5-bromo-3-fluoro-N-methylbenzamide
CID 67263746
2-amino-3-chloro-N-methyl-5-nitrobenzamide
CID 107199890
3-chloro-N-methylnaphthalene-2-carboxamide
CID 133063253
5-amino-4-fluoro-N,2-dimethylbenzamide
CID 130507342
6-amino-N,4-dimethylpyridine-3-carboxamide
CID 131967585
2-chloro-6-methylpyridine-3-carbohydrazide
CID 14056219
6-amino-3-chloro-N-methylpyridine-2-carboxamide
CID 62156050

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide?
The IUPAC name of 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide (CID 169154520) is 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide.
What is the SMILES notation for 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide?
The canonical SMILES for 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide is CNC(=O)c1cc(C)nc(Cl)c1N.
What is the InChIKey of 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide?
The InChIKey is YFIMYEBNBGFCIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O/c1-4-3-5(8(13)11-2)6(10)7(9)12-4/h3H,10H2,1-2H3,(H,11,13).
What are the key properties of 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide?
3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide has a molecular weight of 199.64 g/mol, XLogP of 0.99, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-chloro-N,6-dimethylpyridine-4-carboxamide is sourced from PubChem (CID 169154520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).