2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide

C11H10Cl2N4O — CID 114251518

IUPAC2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide
SMILESCCn1ccc(NC(=O)c2cc(Cl)nc(Cl)c2)n1
InChIInChI=1S/C11H10Cl2N4O/c1-2-17-4-3-10(16-17)15-11(18)7-5-8(12)14-9(13)6-7/h3-6H,2H2,1H3,(H,15,16,18)
InChIKeyMCEHCVQZIHXACH-UHFFFAOYSA-N
MW285.13 g/mol
LogP2.86
Rot. Bonds3

About 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide

2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide (PubChem CID 114251518) has the molecular formula C11H10Cl2N4O and a molecular weight of 285.13 g/mol. Its IUPAC name is 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide
PubChem CID114251518
Molecular FormulaC11H10Cl2N4O
Molecular Weight285.13 g/mol
Exact Mass284.02
IUPAC Name2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide
SMILESCCn1ccc(NC(=O)c2cc(Cl)nc(Cl)c2)n1
InChIInChI=1S/C11H10Cl2N4O/c1-2-17-4-3-10(16-17)15-11(18)7-5-8(12)14-9(13)6-7/h3-6H,2H2,1H3,(H,15,16,18)
InChIKeyMCEHCVQZIHXACH-UHFFFAOYSA-N
XLogP2.86
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.13
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-ethylpyrazol-3-yl)-4-(methylamino)benzamide
CID 114252349
2-chloro-N-(1-ethylpyrazol-3-yl)-4,5-difluorobenzamide
CID 35286238
N-(1-ethylpyrazol-3-yl)pyridine-3-carboxamide
CID 35286222
6-amino-3-chloro-N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide
CID 114252338
3-bromo-N-(1-ethylpyrazol-3-yl)-4-fluorobenzamide
CID 114251537
N-(1-ethylpyrazol-3-yl)-2,3-dihydroxybenzamide
CID 114251339
N-(1-ethylpyrazol-3-yl)pyridine-2-carboxamide
CID 35286531
5-chloro-N-(1-ethylpyrazol-3-yl)-2-methoxybenzamide
CID 35286166
3-N,4-N-bis(1-ethylpyrazol-3-yl)-1-methylpyrazole-3,4-dicarboxamide
CID 29097735
N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-1-ethylpyrazole-3-carboxamide
CID 19285284
1-ethyl-N-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide
CID 19284975
2,6-dichloro-N-(2-ethylphenyl)pyridine-4-carboxamide
CID 26208762

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide?
The IUPAC name of 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide (CID 114251518) is 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide is CCn1ccc(NC(=O)c2cc(Cl)nc(Cl)c2)n1.
What is the InChIKey of 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide?
The InChIKey is MCEHCVQZIHXACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N4O/c1-2-17-4-3-10(16-17)15-11(18)7-5-8(12)14-9(13)6-7/h3-6H,2H2,1H3,(H,15,16,18).
What are the key properties of 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide?
2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide has a molecular weight of 285.13 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(1-ethylpyrazol-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 114251518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).