4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide

C10H13ClN2O — CID 81225000

IUPAC4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide
SMILESCCN(C)C(=O)c1cnc(C)cc1Cl
InChIInChI=1S/C10H13ClN2O/c1-4-13(3)10(14)8-6-12-7(2)5-9(8)11/h5-6H,4H2,1-3H3
InChIKeyPICVPMRQTYAASA-UHFFFAOYSA-N
MW212.68 g/mol
LogP2.14
Rot. Bonds2

About 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide

4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide (PubChem CID 81225000) has the molecular formula C10H13ClN2O and a molecular weight of 212.68 g/mol. Its IUPAC name is 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide
PubChem CID81225000
Molecular FormulaC10H13ClN2O
Molecular Weight212.68 g/mol
Exact Mass212.07
IUPAC Name4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide
SMILESCCN(C)C(=O)c1cnc(C)cc1Cl
InChIInChI=1S/C10H13ClN2O/c1-4-13(3)10(14)8-6-12-7(2)5-9(8)11/h5-6H,4H2,1-3H3
InChIKeyPICVPMRQTYAASA-UHFFFAOYSA-N
XLogP2.14
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-(cyanomethyl)-N,6-dimethylpyridine-3-carboxamide
CID 103817245
4-chloro-N,6-dimethyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 81226216
4-chloro-N-(2-methoxyethyl)-N,6-dimethylpyridine-3-carboxamide
CID 81226512
4-chloro-N,6-dimethyl-N-[3-(methylamino)-3-oxopropyl]pyridine-3-carboxamide
CID 113268050
4-chloro-N-[3-(dimethylamino)propyl]-N-ethyl-6-methylpyridine-3-carboxamide
CID 102978950
4-chloro-N-[(2,4-dichlorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide
CID 81227711
N,N-dibutyl-4-chloro-6-methylpyridine-3-carboxamide
CID 81224997
4-chloro-N,6-dimethyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]pyridine-3-carboxamide
CID 81228294
4-chloro-6-methyl-N-propan-2-yl-N-propylpyridine-3-carboxamide
CID 81225563
N-[(2-bromophenyl)methyl]-4-chloro-N,6-dimethylpyridine-3-carboxamide
CID 81226226
4-chloro-N,6-dimethyl-N-[(2-methylfuran-3-yl)methyl]pyridine-3-carboxamide
CID 81226370
4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 81227477

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide (CID 81225000) is 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide is CCN(C)C(=O)c1cnc(C)cc1Cl.
What is the InChIKey of 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide?
The InChIKey is PICVPMRQTYAASA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O/c1-4-13(3)10(14)8-6-12-7(2)5-9(8)11/h5-6H,4H2,1-3H3.
What are the key properties of 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide?
4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide has a molecular weight of 212.68 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-ethyl-N,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 81225000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).