2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide

C15H15ClN2O — CID 113378289

IUPAC2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(C)nc(Cl)c1
InChIInChI=1S/C15H15ClN2O/c1-3-11-6-4-5-7-13(11)18-15(19)12-8-10(2)17-14(16)9-12/h4-9H,3H2,1-2H3,(H,18,19)
InChIKeyLOSKMIVJGFZYRO-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.86
Rot. Bonds3

About 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide

2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide (PubChem CID 113378289) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide
PubChem CID113378289
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(C)nc(Cl)c1
InChIInChI=1S/C15H15ClN2O/c1-3-11-6-4-5-7-13(11)18-15(19)12-8-10(2)17-14(16)9-12/h4-9H,3H2,1-2H3,(H,18,19)
InChIKeyLOSKMIVJGFZYRO-UHFFFAOYSA-N
XLogP3.86
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.86
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

2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide
CID 26208762
2-chloro-N-(2-ethylphenyl)-6-methylpyrimidine-4-carboxamide
CID 114219422
6-chloro-N-(2-ethylphenyl)-2-methylpyrimidine-4-carboxamide
CID 75538748
N-(2-bromo-3-methylphenyl)-2-chloro-6-methylpyridine-4-carboxamide
CID 113378489
2-chloro-N-[(2-chlorophenyl)methyl]-6-methylpyridine-4-carboxamide
CID 113378301
2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092181
2-chloro-N-[(2-fluorophenyl)methyl]-6-methylpyridine-4-carboxamide
CID 113378285
2-chloro-N-(2-propylphenyl)pyridine-4-carboxamide
CID 31870056
2-chloro-N-[2-(methoxymethyl)phenyl]-6-(methylamino)pyridine-4-carboxamide
CID 62178501
N-(2-ethylphenyl)-6-methyl-2-[(2-methylphenyl)methylamino]pyrimidine-4-carboxamide
CID 109327397
2-chloro-N-ethyl-6-methylpyridine-4-carboxamide
CID 89150895
3-[(2-chloro-6-methylpyridine-4-carbonyl)amino]-4-hydroxybenzoic acid
CID 107264990

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide?
The IUPAC name of 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide (CID 113378289) is 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide?
The canonical SMILES for 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide is CCc1ccccc1NC(=O)c1cc(C)nc(Cl)c1.
What is the InChIKey of 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide?
The InChIKey is LOSKMIVJGFZYRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-3-11-6-4-5-7-13(11)18-15(19)12-8-10(2)17-14(16)9-12/h4-9H,3H2,1-2H3,(H,18,19).
What are the key properties of 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide?
2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide has a molecular weight of 274.75 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-ethylphenyl)-6-methylpyridine-4-carboxamide is sourced from PubChem (CID 113378289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).